SCHEMBL8660475

SCHEMBL8660475

Cc1cc(C)cc(-c2c(F)c(F)c(F)c(F)c2NS(=O)(=O)c2ccccc2)c1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 3/20 0.56
METAP2 P50579 2/20 0.51
CYTH2 Q99418 3/20 0.50
MCL1 Q07820 2/20 0.47
CA12 O43570 2/20 0.46
CA2 P00918 2/20 0.46
CA9 Q16790 2/20 0.46
CA1 P00915 1/20 0.46
NAT1 P18440 1/20 0.46
LMNA P02545 2/20 0.45
MAPT P10636 1/20 0.45
MCOLN3 Q8TDD5 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL8661445 0.90 CA12 (0.51) FFAR4METAP2CYTH2MCL1CA12
SCHEMBL8662846 0.89 MCL1 (0.55) FFAR4METAP2CYTH2MCL1LMNA
SCHEMBL8663489 0.89 CYTH2 (0.54) FFAR4METAP2CYTH2MCL1CA12
SCHEMBL8661428 0.89 CYTH2 (0.54) FFAR4METAP2CYTH2MCL1TSHR
SCHEMBL8657865 0.87 CYTH2 (0.49) FFAR4METAP2CYTH2MCL1CA12
SCHEMBL8661104 0.87 CYTH2 (0.48) FFAR4METAP2CYTH2MCL1CA12
SCHEMBL8660183 0.87 CYTH2 (0.48) FFAR4METAP2CYTH2MCL1TSHR
SCHEMBL8657915 0.86 CYTH2 (0.51) FFAR4METAP2CYTH2MCL1TSHR
SCHEMBL8657558 0.86 ERBB2 (0.47) FFAR4CYTH2NAT1
SCHEMBL8656948 0.85 CYTH2 (0.50) FFAR4METAP2CYTH2MCL1CA12

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-5739166-A ALKYLSULFONYL OR AMINOSULFONYL SUBSTITUTED AROMATIC COMPOUNDS AS NON-STEROIDAL ANTIINFLAMMATORY AGENT G.D. SEARLE & CO. (US) 1998-04-14 US disclosed