SCHEMBL23972147

SCHEMBL23972147

c1ccc(-c2nccc3sc4ccc5ccccc5c4c23)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.47
RAB9A P51151 5/20 0.47
NPC1 O15118 4/20 0.47
L3MBTL1 Q9Y468 4/20 0.47
GPR55 Q9Y2T6 1/20 0.47
MAPT P10636 7/20 0.43
KMT2A Q03164 3/20 0.43
NPSR1 Q6W5P4 2/20 0.43
GLA P06280 1/20 0.43
MAPK1 P28482 5/20 0.41
CYP3A4 P08684 4/20 0.41
ALDH1A1 P00352 3/20 0.41
HPGD P15428 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CASP1 P29466 2/20 0.41
CASP7 P55210 2/20 0.41
ATM Q13315 2/20 0.41
HSD17B10 Q99714 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL24795239 0.81 GPR3 (0.43) KDM4ERAB9ANPC1L3MBTL1GPR55
SCHEMBL2915225 0.80 MAPT (0.54) KDM4ERAB9ANPC1L3MBTL1GPR55
SCHEMBL25569683 0.78 CYP3A4 (0.51) KDM4ERAB9ANPC1L3MBTL1MAPT
SCHEMBL13250616 0.78 HSD17B10 (0.52) RAB9AL3MBTL1MAPK1CYP3A4ALDH1A1
SCHEMBL30062535 0.78 HSD17B10 (0.52) RAB9AL3MBTL1MAPK1CYP3A4ALDH1A1
SCHEMBL18853226 0.74 HPGD (0.40) KDM4ERAB9ANPC1L3MBTL1MAPT
SCHEMBL22258684 0.73 LMNA (0.41) KDM4ERAB9ANPC1L3MBTL1MAPT
SCHEMBL22698402 0.73 ROCK1 (0.39) KDM4ERAB9ANPC1L3MBTL1GPR55
SCHEMBL29398625 0.73 KDM4E (0.66) KDM4ERAB9ANPC1L3MBTL1GPR55
SCHEMBL50715 0.73 KDM4E (0.66) KDM4ERAB9ANPC1L3MBTL1GPR55

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210343950-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORP (US) 2021-11-04 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 (1 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-20210343950-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES AOX1, OCIAD1, OCIAD2 KDM4E 999/4885RAB9A 2199/4885NPC1 429/4885

“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.