SCHEMBL9806493

SCHEMBL9806493

CC(O)c1cccc(Nc2ccccc2C(=O)O)c1Cl

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.57
PTGS2 P35354 3/20 0.57
AKR1C3 P42330 3/20 0.57
KMT2A Q03164 3/20 0.57
TTR P02766 3/20 0.57
LMNA P02545 2/20 0.57
CYP1A2 P05177 2/20 0.57
CYP3A4 P08684 2/20 0.57
CYP2C9 P11712 2/20 0.57
HIF1A Q16665 2/20 0.57
ADORA3 P0DMS8 2/20 0.57
USP2 O75604 1/20 0.57
MT-CO2 P00403 1/20 0.57
PLA2G1B P04054 1/20 0.57
PGR P06401 1/20 0.57
HTR1A P08908 1/20 0.57
ADRA2A P08913 1/20 0.57
AR P10275 1/20 0.57
MAPT P10636 1/20 0.57
HPGD P15428 1/20 0.57

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
SCHEMBL9806500 0.86 MAPT (0.52) MEN1PTGS2AKR1C3KMT2ATTR
SCHEMBL9806482 0.82 AKR1C3 (0.50) MEN1PTGS2AKR1C3KMT2ATTR
SCHEMBL11186246 0.79 MEN1 (0.71) MEN1PTGS2AKR1C3KMT2ATTR
SCHEMBL1186465 0.79 FABP4 (0.59) MEN1PTGS2AKR1C3KMT2ATTR
Clofenamic Acid SCHEMBL29900200 0.79 PBRM1 (0.73) MEN1PTGS2AKR1C3KMT2ATTR
Clofenamic Acid SCHEMBL1477650 0.79 PBRM1 (0.73) MEN1PTGS2AKR1C3KMT2ATTR
SCHEMBL9806562 0.78 AKR1C3 (0.49) MEN1PTGS2AKR1C3KMT2ATTR
SCHEMBL638961 0.77 PBRM1 (0.48) MEN1PTGS2AKR1C3KMT2ATTR
SCHEMBL22662676 0.76 FABP4 (0.66) MEN1PTGS2AKR1C3KMT2ATTR
SCHEMBL30320327 0.76 FABP4 (0.80) MEN1PTGS2AKR1C3KMT2ATTR

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
US-5017604-A Antiinflammatory WARNER-LAMBERT COMPANY (US) 1991-05-21 US disclosed