SCHEMBL12834744

SCHEMBL12834744

Cc1cc(Cl)cc(CCC(=O)O)c1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 11/20 0.49
▸ THRA P10827 3/20 0.47
▸ THRB P10828 3/20 0.47
▸ FFAR4 Q5NUL3 3/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.46
▸ GPR17 Q13304 1/20 0.44
▸ KEAP1 Q14145 1/20 0.44
▸ PPARG P37231 1/20 0.42

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
SCHEMBL5846204 0.86 FFAR1 (0.61) FFAR1THRATHRBFFAR4NPSR1
SCHEMBL1249170 0.86 KEAP1 (0.52) FFAR1THRATHRBFFAR4NPSR1
SCHEMBL10752951 0.85 ALDH1A1 (0.46) FFAR1THRATHRBFFAR4
SCHEMBL1246654 0.81 THRB (0.43) THRATHRB
SCHEMBL14143792 0.79 FFAR1 (0.50) FFAR1THRATHRBFFAR4NPSR1
SCHEMBL26999653 0.78 MCL1 (0.43) FFAR1THRATHRBFFAR4PPARG
SCHEMBL22088079 0.78 FFAR1 (0.49) FFAR1THRATHRBFFAR4NPSR1
SCHEMBL17705230 0.78 THRA (0.50) FFAR1THRATHRBFFAR4NPSR1
SCHEMBL3930469 0.78 FFAR4 (0.47) FFAR1THRATHRBFFAR4GPR17
SCHEMBL13180741 0.76 CNR1 (0.38) —

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-2292592-A1 SULFONAMIDE COMPOUND AND APPLICATION THEREOF Asahi Kasei Pharma Corporation (JP) 2011-03-09 — — EP disclosed
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