SCHEMBL8660183

SCHEMBL8660183

O=S(=O)(Nc1c(F)c(F)c(F)c(F)c1-c1cc(F)cc(F)c1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYTH2 Q99418 2/20 0.48
FFAR4 Q5NUL3 1/20 0.46
KAT6A Q92794 3/20 0.44
NPSR1 Q6W5P4 1/20 0.43
PTGES2 Q9H7Z7 1/20 0.43
SLC40A1 Q9NP59 1/20 0.43
METAP2 P50579 1/20 0.43
IL1RN P18510 1/20 0.42
KEAP1 Q14145 1/20 0.42
ERAP1 Q9NZ08 1/20 0.42
MCL1 Q07820 1/20 0.42
TSHR P16473 1/20 0.42
GAA P10253 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
SCHEMBL8659718 0.89 KAT6A (0.54) CYTH2FFAR4KAT6ANPSR1TSHR
SCHEMBL8661104 0.88 CYTH2 (0.48) CYTH2FFAR4NPSR1SLC40A1METAP2
SCHEMBL8661428 0.87 CYTH2 (0.54) CYTH2FFAR4KAT6ASLC40A1METAP2
SCHEMBL8663489 0.87 CYTH2 (0.54) CYTH2FFAR4KAT6AMETAP2MCL1
SCHEMBL8660475 0.87 FFAR4 (0.56) CYTH2FFAR4METAP2MCL1TSHR
SCHEMBL8657558 0.87 ERBB2 (0.47) CYTH2FFAR4KAT6AGAA
SCHEMBL8658156 0.87 NPSR1 (0.50) CYTH2FFAR4KAT6ANPSR1KEAP1
SCHEMBL8657865 0.86 CYTH2 (0.49) CYTH2FFAR4KAT6AMETAP2MCL1
SCHEMBL8661364 0.86 KAT6A (0.49) CYTH2FFAR4KAT6ASLC40A1TSHR
SCHEMBL8661445 0.85 CA12 (0.51) CYTH2FFAR4METAP2KEAP1MCL1

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