SCHEMBL6598549

SCHEMBL6598549

OCc1ccc2csccc1-2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
MAPT P10636 1/20 0.39
ALOX15 P16050 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CYP2A6 P11509 4/20 0.35
CYP2B6 P20813 3/20 0.35
CYP2E1 P05181 2/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
CHEK1 O14757 1/20 0.35
KCNH2 Q12809 1/20 0.34
TDO2 P48775 1/20 0.34
CYP17A1 P05093 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL6599324 0.85 ESR1 (0.41) MEN1KMT2ACYP2A6CYP2B6CYP2E1
SCHEMBL477489 0.84 CYP2A6 (0.47) MEN1USP2MAPTALOX15KMT2A
SCHEMBL8051996 0.79 MEN1 (0.36) MEN1USP2MAPTALOX15KMT2A
SCHEMBL28104229 0.79 MEN1 (0.36) MEN1USP2MAPTALOX15KMT2A
SCHEMBL28141334 0.79 USP2 (0.39) MEN1USP2MAPTALOX15KMT2A
SCHEMBL2091183 0.76 MEN1 (0.34) MEN1USP2MAPTALOX15KMT2A
SCHEMBL14686301 0.74 CNR1 (0.37) MEN1USP2MAPTALOX15KMT2A
SCHEMBL9111503 0.72 MEN1 (0.32) MEN1USP2MAPTALOX15KMT2A
SCHEMBL27329701 0.72 MEN1 (0.38) MEN1USP2MAPTALOX15KMT2A
SCHEMBL277051 0.71 PELI1 (0.50) HSD17B10CYP2A6CYP2B6CYP2E1ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1385833-A1 TRIAZINYL AMIDE DERIVATIVES AS ANGIOGENESIS INHIBITORS Amgen Inc. (US) 2004-02-04 EP disclosed
WO-2002083654-A1 TRIAZINYL AMIDE DERIVATIVES AS ANGIOGENESIS INHIBITORS AMGEN INC. (US) 2002-10-24 WO disclosed