SCHEMBL22945967

SCHEMBL22945967

c1ccc(-c2nc(-c3cccc4c(N5c6ccccc6-c6cccc7cccc5c67)cccc34)nc3c2oc2ccccc23)nc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 4/20 0.36
NPC1 O15118 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
MAPT P10636 3/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36
MAPK1 P28482 2/20 0.36
TP53 P04637 1/20 0.36
TGFBR1 P36897 1/20 0.33
TSHR P16473 4/20 0.32
LMNA P02545 3/20 0.31
RAB9A P51151 2/20 0.31
HTT P42858 2/20 0.31
MEN1 O00255 1/20 0.31
USP2 O75604 1/20 0.31
KMT2A Q03164 1/20 0.31
AHR P35869 1/20 0.31
GAA P10253 2/20 0.31
PIM1 P11309 1/20 0.30

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
SCHEMBL22945183 0.93 NPC1 (0.34) ALDH1A1KDM4ENPC1SMN1; SMN2MAPT
SCHEMBL22945117 0.90 KDM4E (0.36) ALDH1A1KDM4ENPC1SMN1; SMN2MAPT
SCHEMBL22946012 0.90 ALDH1A1 (0.36) ALDH1A1KDM4ENPC1SMN1; SMN2MAPT
SCHEMBL22944719 0.87 TSHR (0.36) ALDH1A1KDM4ENPC1SMN1; SMN2MAPT
SCHEMBL22944960 0.87 ALOX5 (0.34) ALDH1A1KDM4ESMN1; SMN2MAPTHSD17B10
SCHEMBL22945571 0.84 PDE6D (0.35) ALDH1A1KDM4ENPC1SMN1; SMN2MAPT
SCHEMBL22945921 0.82 TSHR (0.34) ALDH1A1KDM4ENPC1SMN1; SMN2MAPT
SCHEMBL21515438 0.82 METAP1 (0.42) ALDH1A1KDM4ENPC1SMN1; SMN2MAPT
SCHEMBL22945158 0.80 TSHR (0.34) ALDH1A1KDM4ENPC1SMN1; SMN2MAPT
SCHEMBL22944859 0.80 TGFBR1 (0.34) ALDH1A1KDM4ENPC1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11812658-B2 Compound and organic light emitting diode comprising same LG CHEM, LTD. (KR) 2023-11-07 US disclosed
US-11812658-B2 Compound and organic light emitting diode comprising same LG CHEM, LTD. (KR) 2023-11-07 US disclosed
US-20210036236-A1 COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LG CHEM, LTD. (KR) 2021-02-04 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 (2 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-20210036236-A1 COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME DRD1, DRD3, DRD2 ALDH1A1 271/4885KDM4E 1857/4885NPC1 2397/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 ALDH1A1 271/4885KDM4E 1857/4885NPC1 2397/4885

“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.