SCHEMBL7570694

SCHEMBL7570694

CC(C)c1ccc(S(=O)(=O)Nc2cccc(O)c2NS(=O)(=O)c2ccc(C(C)C)cc2)cc1.Cc1ccc(S(=O)(=O)Nc2ccccc2O)cc1.O=S(=O)(Nc1cccc(O)c1NS(=O)(=O)c1ccc(OC(F)(F)F)cc1)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 2/20 0.48
▸ UQCRB P14927 1/20 0.45
▸ HSD17B2 P37059 1/20 0.45
▸ LMNA P02545 4/20 0.44
▸ MAPT P10636 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ USP2 O75604 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ NOD2 Q9HC29 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ GAA P10253 3/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ CCR9 P51686 2/20 0.42
▸ EP300 Q09472 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
SCHEMBL7574025 0.85 FFAR4 (0.56) FFAR4UQCRBHSD17B2LMNAMAPT
SCHEMBL7579848 0.81 GAA (0.50) UQCRBHSD17B2LMNAMAPTALDH1A1
SCHEMBL7572310 0.77 ALDH1A1 (0.66) FFAR4UQCRBHSD17B2LMNAMAPT
SCHEMBL1348234 0.75 LMNA (0.75) UQCRBHSD17B2LMNAMAPTALDH1A1
SCHEMBL7589382 0.72 FFAR4 (0.71) FFAR4MAPTALDH1A1CYP2C9GAA
SCHEMBL12407078 0.71 FFAR4 (0.55) FFAR4LMNAMAPTPOLBGAA
SCHEMBL12096927 0.71 FFAR4 (0.49) FFAR4LMNAMAPTALDH1A1GAA
SCHEMBL10143422 0.70 FFAR4 (0.57) FFAR4GAAKMT2ACCR9
SCHEMBL7570701 0.70 PTGES2 (0.60) FFAR4UQCRBHSD17B2LMNAMAPT
SCHEMBL29087421 0.70 KMT2A (0.64) FFAR4GAAKMT2AMEN1CCR9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1239852-A2 BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS Arrow Therapeutics Limited (GB) 2002-09-18 — — EP disclosed
WO-2001028537-A2 BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS ARROW THERAPEUTICS LIMITED (GB) 2001-04-26 — — WO disclosed
Send feedback