SCHEMBL9115693

SCHEMBL9115693

COc1ccc(S(=O)(=O)N(C)c2ccc(F)cc2)cc1-c1ccc[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.46
HSD17B10 Q99714 2/20 0.42
HPGD P15428 1/20 0.42
DRD2 P14416 5/20 0.42
DRD3 P35462 5/20 0.42
KMT2A Q03164 1/20 0.40
MAPT P10636 3/20 0.40
LMNA P02545 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
CNR1 P21554 1/20 0.40
HTT P42858 1/20 0.40
GPR55 Q9Y2T6 1/20 0.40
PGR P06401 2/20 0.40
CDK2 P24941 1/20 0.39
ALDH1A1 P00352 1/20 0.39
KDM4E B2RXH2 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL9053039 0.90 PGR (0.51) DRD2DRD3KMT2AMAPTLMNA
SCHEMBL9053622 0.90 DRD2 (0.50) DRD2DRD3KMT2AMAPTLMNA
SCHEMBL9051914 0.89 MAPT (0.42) DRD2DRD3KMT2AMAPTLMNA
SCHEMBL9053598 0.86 SIRT2 (0.46) DRD2DRD3MAPTLMNAPGR
SCHEMBL9053358 0.86 PSEN1 (0.43) DRD2DRD3MAPTLMNANPSR1
SCHEMBL8544314 0.83 MAPT (0.54) DRD2DRD3KMT2AMAPTHTT
SCHEMBL9053693 0.82 CYP11B1 (0.44) HSD17B10HPGDDRD2DRD3KMT2A
SCHEMBL9053185 0.81 MAPT (0.50) DRD2DRD3KMT2AMAPTLMNA
SCHEMBL9054157 0.80 DRD2 (0.41) HPGDDRD2DRD3KMT2ALMNA
SCHEMBL8545748 0.78 ALDH1A1 (0.54) DRD2DRD3KMT2AMAPTLMNA

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
WO-1995016674-A1 AMINOSULPHONYL-PHENYL-1H-PYRROLE DERIVATIVES, METHOD OF THEIR PREPARATION AND THEIR USE SMITHKLINE BEECHAM PLC (GB) 1995-06-22 WO disclosed