SCHEMBL8764829

SCHEMBL8764829

Cc1ccccc1C(=O)c1cccnc1[C]=O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 1/20 0.44
WNT3A P56704 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
KMT2A Q03164 1/20 0.43
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
KDM4E B2RXH2 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MYC P01106 1/20 0.40
ELANE P08246 1/20 0.40
TYK2 P29597 1/20 0.40
ENPP3 O14638 1/20 0.39
ALPL P05186 1/20 0.39
XIAP P98170 1/20 0.39
P2RX7 Q99572 1/20 0.38

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
SCHEMBL4078561 0.80 KMT2A (0.49) L3MBTL1KMT2ANPC1RAB9AKDM4E
SCHEMBL2783136 0.79 KMT2A (0.51) CTNNB1WNT3AL3MBTL1KMT2ANPC1
SCHEMBL8833113 0.78 KDM4E (0.42) L3MBTL1KMT2AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL4706785 0.77 CTNNB1 (0.46) CTNNB1WNT3AL3MBTL1KMT2ANPC1
SCHEMBL2520189 0.77
SCHEMBL333141 0.76 CYP3A4 (0.55) KMT2ASMN1; SMN2ALDH1A1ENPP3ALPL
SCHEMBL29387256 0.76 CYP3A4 (0.55) KMT2ASMN1; SMN2ALDH1A1ENPP3ALPL
SCHEMBL8833877 0.75 KDM4E (0.59) L3MBTL1KMT2ANPC1RAB9AKDM4E
SCHEMBL2745986 0.75 KMT2A (0.47) L3MBTL1KMT2AKDM4EALDH1A1
SCHEMBL7851627 0.75 KDM4E (0.62) CTNNB1WNT3AL3MBTL1KMT2AKDM4E

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
EP-0582579-B1 N-AMINOPYRIDONE DYES BASF AG (DE) 1997-05-28 EP disclosed
EP-0582579-A1 N-AMINOPYRIDONE DYES. BASF AG (DE) 1994-02-16 EP disclosed
WO-1992019684-A1 N-AMINOPYRIDONE DYES BASF AKTIENGESELLSCHAFT (DE) 1992-11-12 WO disclosed