SCHEMBL15977199

SCHEMBL15977199

N#Cc1ccc(-n2c3ccccc3c3ccncc32)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 3/20 0.50
USP14 P54578 3/20 0.47
KDM4E B2RXH2 1/20 0.44
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP11B2 P19099 2/20 0.41
PTGER4 P35408 1/20 0.40
CDK4 P11802 1/20 0.39
CDK6 Q00534 1/20 0.39
CHRNB2 P17787 1/20 0.39
CHRNA5 P30532 1/20 0.39
CHRNA4 P43681 1/20 0.39
CHUK O15111 1/20 0.38
RPS6KB1 P23443 1/20 0.38
GSK3B P49841 1/20 0.38
ROCK2 O75116 1/20 0.38
MAPK1 P28482 1/20 0.37

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
SCHEMBL15250592 0.89 KDM4E (0.42) CYP19A1USP14KDM4EATML3MBTL1
SCHEMBL21337437 0.87 CYP19A1 (0.40) CYP19A1USP14KDM4EATML3MBTL1
SCHEMBL17721860 0.87 CYP11B2 (0.44) CYP19A1USP14KDM4EATML3MBTL1
SCHEMBL30490534 0.86 KDM4E (0.59) USP14KDM4EATML3MBTL1PTGER4
SCHEMBL30490535 0.86 KDM4E (0.59) USP14KDM4EATML3MBTL1PTGER4
SCHEMBL3402733 0.86 KDM4E (0.59) USP14KDM4EATML3MBTL1PTGER4
SCHEMBL30401515 0.86 KDM4E (0.59) USP14KDM4EATML3MBTL1PTGER4
SCHEMBL18388702 0.85 CYP19A1 (0.42) CYP19A1USP14KDM4EATML3MBTL1
SCHEMBL18381865 0.84 KDM4E (0.57) USP14KDM4EATML3MBTL1PTGER4
SCHEMBL21337442 0.84 CHUK (0.42) CYP19A1USP14KDM4EATML3MBTL1

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
EP-1786242-B1 ORGANIC ELECTROLUMINESCENCE DEVICE, DISPLAY APPARATUS AND LIGHTING APPARATUS KONICA MINOLTA HOLDINGS INC (JP) 2014-08-27 EP disclosed