SCHEMBL7412985

SCHEMBL7412985

Cc1cc(F)cnc1NC(=O)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.42
AGBL2 Q5U5Z8 1/20 0.41
LCK P06239 3/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA9 Q16790 1/20 0.38
RORC P51449 3/20 0.38
SSTR4 P31391 1/20 0.37
ATR Q13535 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
GSK3B P49841 1/20 0.36
DYRK1A Q13627 1/20 0.36
MAPKAPK2 P49137 1/20 0.36
AAK1 Q2M2I8 1/20 0.36
CYP17A1 P05093 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
SCHEMBL5456915 0.87 SYK (0.46) SYKRORCATRGSK3BDYRK1A
SCHEMBL7416577 0.85 LCK (0.45) LCKCA12CA1CA9RORC
SCHEMBL19779578 0.84 AGBL2 (0.45) AGBL2SSTR4NPC1RAB9A
SCHEMBL29995121 0.84 SYK (0.42) SYKCA1RORCATRGSK3B
SCHEMBL24364156 0.82 MAPKAPK2 (0.40) SYKLCKCA12CA1CA9
SCHEMBL30469570 0.82 MAPKAPK2 (0.40) SYKLCKCA12CA1CA9
SCHEMBL1181471 0.82 AAK1 (0.51) LCKCA12CA1CA9RORC
SCHEMBL15614476 0.80 MAPK1 (0.43) SYKLCKCA12CA1CA9
SCHEMBL29995208 0.80 PRMT1 (0.40) SYKRORCNPC1RAB9A
SCHEMBL21783538 0.79 CYP17A1 (0.40) SYKLCKRORCATRAAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0640080-A1 SUBSTITUTED INDOLES AND AZAINDOLES AS ANGIOTENSIN II ANTAGONISTS. SYNTEX INC (US) 1995-03-01 EP disclosed
US-5380739-A Angiotensin II antagonists SYNTEX (U.S.A.) INC. (US) 1995-01-10 US disclosed
WO-1993023391-A1 SUBSTITUTED INDOLES AND AZAINDOLES AS ANGIOTENSIN II ANTAGONISTS SYNTEX (U.S.A.) INC. (US) 1993-11-25 WO disclosed
US-5212195-A Substituted indole antagonists derivatives which are angiotensin II SYNTEX (U.S.A.) INC. (US) 1993-05-18 US disclosed