SCHEMBL19367171

SCHEMBL19367171

c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
ATM Q13315 1/20 0.50
CYP19A1 P11511 1/20 0.41
KMT2A Q03164 6/20 0.40
MEN1 O00255 5/20 0.40
RAB9A P51151 1/20 0.40
ACHE P22303 1/20 0.38
GAA P10253 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 1/20 0.37
DHODH Q02127 1/20 0.37
PDE10A Q9Y233 2/20 0.37
ADORA1 P30542 2/20 0.36

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
SCHEMBL4547011 0.98 L3MBTL1 (0.52) KDM4EL3MBTL1ATMCYP19A1KMT2A
SCHEMBL14425637 0.97 ATM (0.47) KDM4EL3MBTL1ATMCYP19A1KMT2A
SCHEMBL14425633 0.97 ATM (0.47) KDM4EL3MBTL1ATMCYP19A1KMT2A
SCHEMBL8739849 0.97 KDM4E (0.47) KDM4EL3MBTL1ATMCYP19A1KMT2A
SCHEMBL8739848 0.97 KDM4E (0.50) KDM4EL3MBTL1ATMCYP19A1KMT2A
SCHEMBL4547020 0.97 L3MBTL1 (0.50) KDM4EL3MBTL1ATMCYP19A1KMT2A
SCHEMBL4407125 0.97 L3MBTL1 (0.50) KDM4EL3MBTL1ATMCYP19A1KMT2A
SCHEMBL11992448 0.97 L3MBTL1 (0.50) KDM4EL3MBTL1ATMCYP19A1KMT2A
SCHEMBL17539765 0.96 ATM (0.46) KDM4EL3MBTL1ATMCYP19A1KMT2A
SCHEMBL17539748 0.96 ATM (0.46) KDM4EL3MBTL1ATMCYP19A1KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11329234-B2 Organic electroluminescent element, display device, lighting device, π-conjugated compound, and light-emitting thin film MERCK PATENT GMBH (DE) 2022-05-10 US disclosed
US-10950799-B2 Organic electroluminescent element, display device, lighting device, PI-conjugated compound, and light-emitting thin film MERCK PATENT GMBH (DE) 2021-03-16 US disclosed
US-20200044164-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, LIGHTING DEVICE, PI-CONJUGATED COMPOUND, AND LIGHT-EMITTING THIN FILM UDC IRELAND LIMITED (IE) 2020-02-06 US disclosed
US-20170271597-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, LIGHTING DEVICE, PI-CONJUGATED COMPOUND, AND LIGHT-EMITTING THIN FILM MERCK PATENT GMBH (DE) 2017-09-21 US disclosed
US-20170271597-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, LIGHTING DEVICE, PI-CONJUGATED COMPOUND, AND LIGHT-EMITTING THIN FILM MERCK PATENT GMBH (DE) 2017-09-21 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 (4 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-20200044164-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, LIGHTING DEVICE, PI-CONJUGATED COMPOUND, AND LIGHT-EMITTING THIN FILM LPO, L1CAM, INTS9 KDM4E 3395/4885L3MBTL1 298/4885ATM 2618/4885
US-10950799-B2 Organic electroluminescent element, display device, lighting device, PI-conjugated compound, and light-emitting thin film LPO, L1CAM, INTS9 KDM4E 3395/4885L3MBTL1 298/4885ATM 2618/4885
US-20170271597-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, LIGHTING DEVICE, PI-CONJUGATED COMPOUND, AND LIGHT-EMITTING THIN FILM LPO, L1CAM, INTS9 KDM4E 3676/4885L3MBTL1 343/4885ATM 2915/4885
US-11329234-B2 Organic electroluminescent element, display device, lighting device, π-conjugated compound, and light-emitting thin film LPO, L1CAM, SELE KDM4E 2979/4885L3MBTL1 197/4885ATM 2357/4885

“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.