SCHEMBL7572525

SCHEMBL7572525

O=S(=O)(Nc1ccc(Cl)cc1)c1ccc(F)cc1F

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 6/20 0.63
IDH1 O75874 5/20 0.56
CES1 P23141 1/20 0.51
POLB P06746 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
PIK3CB P42338 1/20 0.50
RORC P51449 1/20 0.49
BRD4 O60885 1/20 0.49

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
SCHEMBL97723 0.84 POLB (0.50) CCR2POLBPIK3CBRORCBRD4
SCHEMBL8125111 0.84 GAA (0.54) CCR2POLBPIK3CBRORCBRD4
SCHEMBL17609451 0.83 PTK2B (0.55) CCR2POLBPIK3CBRORCBRD4
SCHEMBL8113005 0.82 POLB (0.51) CCR2POLBPIK3CBRORCBRD4
SCHEMBL3771893 0.81 CCR2 (0.60) CCR2
SCHEMBL15836458 0.80 PIK3CB (0.47) CCR2POLBPIK3CBRORCBRD4
SCHEMBL7571634 0.80 SLC22A12 (0.53) CCR2POLBPIK3CBRORCBRD4
SCHEMBL15713386 0.80 PTK2B (0.59) POLBTDP1RORC
SCHEMBL1638685 0.78 CCR2 (0.56) CCR2POLB
SCHEMBL22095987 0.78 SMN1; SMN2 (0.78)

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