SCHEMBL10691270

SCHEMBL10691270

COc1cc(SC)ccc1-c1nc2nc[nH]c(=O)c2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 4/20 0.44
FGFR2 P21802 4/20 0.44
PDE5A O76074 2/20 0.43
ENPP1 P22413 1/20 0.43
SRC P12931 1/20 0.42
PDE2A O00408 1/20 0.39
KDM4E B2RXH2 2/20 0.39
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 1/20 0.39
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
HSD17B10 Q99714 1/20 0.38
BRD4 O60885 1/20 0.36
MAPK1 P28482 1/20 0.36
ADORA2B P29275 1/20 0.36

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
SCHEMBL10691876 0.85 PDE2A (0.55) FGFR1FGFR2PDE5AENPP1SRC
SCHEMBL10688935 0.81 FGFR1 (0.43) FGFR1FGFR2PDE5AENPP1SRC
SCHEMBL10686264 0.81 ENPP1 (0.45) FGFR1FGFR2PDE5AENPP1SRC
SCHEMBL10692611 0.80 ENPP1 (0.46) FGFR1FGFR2PDE5AENPP1SRC
SCHEMBL10688379 0.80 FGFR1 (0.45) FGFR1FGFR2PDE5AENPP1SRC
SCHEMBL10688023 0.80 FGFR1 (0.42) FGFR1FGFR2PDE5AENPP1SRC
SCHEMBL10693992 0.78 TNNI3K (0.41) FGFR1FGFR2PDE5AENPP1SRC
SCHEMBL10685682 0.78 MAPT (0.45) FGFR1FGFR2PDE5AENPP1SRC
SCHEMBL10673882 0.75 PDE2A (0.48) PDE5AENPP1PDE2AKDM4ECYP1A2
SCHEMBL10848272 0.74 PDE2A (0.40) PDE5APDE2AKDM4ECYP1A2MEN1

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
US-4722929-A Novel 2-phenyl-imidazoles and pharmaceutical compositions containing same DR. KARL THOMAE GMBH (DE) 1988-02-02 US disclosed
EP-0149200-A1 Novel 2-pnenyl-imidazoles, their preparation and drugs containing them Dr. Karl Thomae GmbH (DE) 1985-07-24 EP disclosed