SCHEMBL12787331

SCHEMBL12787331

c1ccc(N2CN(c3ccccc3)c3cc4ccccc4cc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 4/20 0.37
LMNA P02545 3/20 0.37
ALDH1A1 P00352 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
MAPK1 P28482 1/20 0.37
GFER P55789 1/20 0.37
ATM Q13315 1/20 0.35
CYP3A4 P08684 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MYC P01106 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL22447052 0.86 SIGMAR1 (0.52) SIGMAR1NPC1RAB9AMEN1KMT2A
SCHEMBL12514331 0.86 ALDH1A1 (0.41) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL30261935 0.80 SIGMAR1 (0.48) SIGMAR1NPC1RAB9AMEN1KMT2A
SCHEMBL12153468 0.80 SIGMAR1 (0.48) SIGMAR1NPC1RAB9AMEN1KMT2A
SCHEMBL18964726 0.80 NPC1 (0.48) SIGMAR1NPC1RAB9AMEN1KMT2A
SCHEMBL45191 0.79 SIGMAR1 (0.43) SIGMAR1NPC1RAB9AMEN1KMT2A
SCHEMBL23870655 0.78 ALDH1A1 (0.50) SIGMAR1NPC1RAB9AMEN1KMT2A
SCHEMBL16281051 0.73 MGLL (0.42) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL21272270 0.73 MGLL (0.42) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL30076295 0.73 MGLL (0.42) MEN1KMT2AALDH1A1KDM4EGAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11539005-B2 Transition metal complexes comprising carbene ligands serving as emitters for organic light-emitting diodes (OLED's) UDC IRELAND LIMITED (IE) 2022-12-27 US disclosed
EP-3805338-A1 TRANSITION METAL COMPLEXES COMPRISING CARBENE LIGANDS AS EMITTERS FOR ORGANIC LIGHT-EMITTING DIODES (OLEDS) UDC Ireland Limited (IE) 2021-04-14 EP disclosed
US-20200266366-A1 TRANSITION METAL COMPLEXES COMPRISING CARBENE LIGANDS SERVING AS EMITTERS FOR ORGANIC LIGHT-EMITTING DIODES (OLED'S) UDC IRELAND LTD (IE) 2020-08-20 US disclosed
US-10573828-B2 Transition metal complexes comprising carbene ligands serving as emitters for organic light-emitting diodes (OLED's) UDC IRELAND LIMITED (IE) 2020-02-25 US disclosed
EP-3299437-A1 TRANSITION METAL COMPLEXES COMPRISING CARBENE LIGANDS AS EMITTER FOR ORGANIC LIGHT-EMITTING DIODES (OLEDS) UDC Ireland Limited (IE) 2018-03-28 EP disclosed
US-20170365802-A1 TRANSITION METAL COMPLEXES COMPRISING CARBENE LIGANDS SERVING AS EMITTERS FOR ORGANIC LIGHT-EMITTING DIODES (OLED'S) UDC IRELAND LTD (IE) 2017-12-21 US disclosed
US-20170365802-A1 TRANSITION METAL COMPLEXES COMPRISING CARBENE LIGANDS SERVING AS EMITTERS FOR ORGANIC LIGHT-EMITTING DIODES (OLED'S) UDC IRELAND LTD (IE) 2017-12-21 US disclosed
EP-1658349-B1 USE OF TRANSITION METAL COMPLEXES COMPRISING CARBENE LIGANDS SERVING AS EMITTERS FOR ORGANIC LIGHT-EMITTING DIODES (OLEDs) AND OLEDs UDC IRELAND LTD (IE) 2017-09-20 EP disclosed
US-9748498-B2 Transition metal complexes comprising carbene ligands serving as emitters for organic light-emitting diodes (OLED's) UDC IRELAND LIMITED (IE) 2017-08-29 US disclosed
US-9748498-B2 Transition metal complexes comprising carbene ligands serving as emitters for organic light-emitting diodes (OLED's) UDC IRELAND LIMITED (IE) 2017-08-29 US disclosed
US-8377740-B2 Transition metal complexes comprising carbene ligands serving as emitters for organic light-emitting diodes (OLED's) BASF SE (DE) 2013-02-19 US disclosed
US-8377740-B2 Transition metal complexes comprising carbene ligands serving as emitters for organic light-emitting diodes (OLED's) BASF SE (DE) 2013-02-19 US disclosed
US-20110049501-A1 TRANSITION METAL COMPLEXES COMPRISING CARBENE LIGANDS SERVING AS EMITTERS FOR ORGANIC LIGHT-EMITTING DIODES (OLED'S) BASF AKTIENGESELLSCHAFT (DE) 2011-03-03 US disclosed
US-20110049500-A1 TRANSITION METAL COMPLEXES COMPRISING CARBENE LIGANDS SERVING AS EMITTERS FOR ORGANIC LIGHT-EMITTING DIODES (OLED'S) BASF AKTIENGESELLSCHAFT (DE) 2011-03-03 US disclosed
US-20110049499-A1 TRANSITION METAL COMPLEXES COMPRISING CARBENE LIGANDS SERVING AS EMITTERS FOR ORGANIC LIGHT-EMITTING DIODES (OLED'S) BASF AKTIENGESELLSCHAFT (DE) 2011-03-03 US disclosed
US-20110049500-A1 TRANSITION METAL COMPLEXES COMPRISING CARBENE LIGANDS SERVING AS EMITTERS FOR ORGANIC LIGHT-EMITTING DIODES (OLED'S) BASF AKTIENGESELLSCHAFT (DE) 2011-03-03 US disclosed
US-20110049501-A1 TRANSITION METAL COMPLEXES COMPRISING CARBENE LIGANDS SERVING AS EMITTERS FOR ORGANIC LIGHT-EMITTING DIODES (OLED'S) BASF AKTIENGESELLSCHAFT (DE) 2011-03-03 US disclosed
US-20110049499-A1 TRANSITION METAL COMPLEXES COMPRISING CARBENE LIGANDS SERVING AS EMITTERS FOR ORGANIC LIGHT-EMITTING DIODES (OLED'S) BASF AKTIENGESELLSCHAFT (DE) 2011-03-03 US disclosed
US-7846763-B2 starting from N,N-diphenylethane-1,2-diamine; bisamine is reacted with triethyl formate in the presence of ammonium tetrafluoroborate; suitable for producing electroluminescence in the blue, red and green regions of the electromagnetic spectrum BASF AKTIENGESELLSCHAFT (DE) 2010-12-07 US disclosed
US-7846763-B2 starting from N,N-diphenylethane-1,2-diamine; bisamine is reacted with triethyl formate in the presence of ammonium tetrafluoroborate; suitable for producing electroluminescence in the blue, red and green regions of the electromagnetic spectrum BASF AKTIENGESELLSCHAFT (DE) 2010-12-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110049500-A1 TRANSITION METAL COMPLEXES COMPRISING CARBENE LIGANDS SERVING AS EMITTERS FOR ORGANIC LIGHT-EMITTING DIODES (OLED'S) CHRM1, OCIAD1, OPRD1 SIGMAR1 522/4885NPC1 659/4885RAB9A 1824/4885
US-20170365802-A1 TRANSITION METAL COMPLEXES COMPRISING CARBENE LIGANDS SERVING AS EMITTERS FOR ORGANIC LIGHT-EMITTING DIODES (OLED'S) CHRM1, OCIAD1, OPRD1 SIGMAR1 522/4885NPC1 659/4885RAB9A 1824/4885
US-20200266366-A1 TRANSITION METAL COMPLEXES COMPRISING CARBENE LIGANDS SERVING AS EMITTERS FOR ORGANIC LIGHT-EMITTING DIODES (OLED'S) CHRM1, OPRD1, DRD1 SIGMAR1 828/4885NPC1 1012/4885RAB9A 1108/4885
US-20110049501-A1 TRANSITION METAL COMPLEXES COMPRISING CARBENE LIGANDS SERVING AS EMITTERS FOR ORGANIC LIGHT-EMITTING DIODES (OLED'S) CHRM1, OCIAD1, OPRD1 SIGMAR1 522/4885NPC1 659/4885RAB9A 1824/4885
US-10573828-B2 Transition metal complexes comprising carbene ligands serving as emitters for organic light-emitting diodes (OLED's) OCIAD1, OPRD1, CHRM1 SIGMAR1 605/4885NPC1 809/4885RAB9A 1339/4885
US-11539005-B2 Transition metal complexes comprising carbene ligands serving as emitters for organic light-emitting diodes (OLED's) CHRM1, OPRD1, DRD1 SIGMAR1 828/4885NPC1 1012/4885RAB9A 1108/4885
US-20110049499-A1 TRANSITION METAL COMPLEXES COMPRISING CARBENE LIGANDS SERVING AS EMITTERS FOR ORGANIC LIGHT-EMITTING DIODES (OLED'S) CHRM1, OCIAD1, OPRD1 SIGMAR1 522/4885NPC1 659/4885RAB9A 1824/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.