SCHEMBL7211646

SCHEMBL7211646

CCCNCCc1ccc(NS(=O)(=O)c2ccc(F)cc2Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.48
FFAR4 Q5NUL3 1/20 0.48
ACLY P53396 1/20 0.46
BRD4 O60885 3/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
CA14 Q9ULX7 1/20 0.45
SGK1 O00141 5/20 0.43
GRIN1 Q05586 1/20 0.42
KCNH2 Q12809 1/20 0.42
GRIN2B Q13224 1/20 0.42
TP53 P04637 1/20 0.42
HTR6 P50406 2/20 0.41
PFKFB3 Q16875 1/20 0.41
ADRB2 P07550 1/20 0.41
ADRB1 P08588 1/20 0.41
ADRB3 P13945 1/20 0.41
IDH1 O75874 1/20 0.41

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
SCHEMBL7212972 0.88 ACLY (0.53) ACLYCA1CA2CA7CA9
Propane SCHEMBL7213006 0.83 CA1 (0.49) FFAR1FFAR4ACLYBRD4CA1
SCHEMBL7213002 0.78 ACLY (0.49) FFAR1FFAR4ACLYBRD4CA1
SCHEMBL7208101 0.75 PRMT1 (0.62) FFAR1FFAR4CA1CA2CA9
SCHEMBL95834 0.74 BRD4 (0.51) BRD4CA1CA2CA7CA9
SCHEMBL13629290 0.74 BRD4 (0.52) BRD4SGK1HTR6PFKFB3ALDH1A1
SCHEMBL14018751 0.74 ALDH1A1 (0.63) ACLYBRD4CA1CA2SGK1
SCHEMBL13629339 0.73 BRD4 (0.51) BRD4SGK1TP53HTR6PFKFB3
SCHEMBL4445364 0.72 KDM4E (0.58) GRIN1KCNH2GRIN2BADRB2ADRB1
SCHEMBL7931494 0.72 L3MBTL1 (0.65) CA1CA2KCNH2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1152857-C Phenylsulfonamide-phenylethylamines useful as dopamine receptors �������Ŷ���Լ��������˾ 2004-06-09 CN claimed
EP-1077935-B1 PHENYLSULFONAMIDE-PHENYLETHYLAMINES USEFUL AS DOPAMINE RECEPTORS UPJOHN CO (US) 2003-10-29 EP claimed
CN-1297431-A Phenylsulfonamide-phenylethylamines useful as dopamine receptors UPJOHN CO (US) 2001-05-30 CN claimed
EP-1077935-A1 PHENYLSULFONAMIDE-PHENYLETHYLAMINES USEFUL AS DOPAMINE RECEPTORS PHARMACIA & UPJOHN COMPANY (US) 2001-02-28 EP claimed
US-6103766-A SUBSTITUTED OR UNSUBSTITUTED PHENYLSULFONAMIDE-PHENYLAMINE DERIVATIVES USEFUL FOR TREATING THE DISORDERS RELATED TO CENTRAL NERVOUS SYSTEM PHARMACIA & UPJOHN COMPANY (US) 2000-08-15 US claimed
WO-1999058499-A1 PHENYLSULFONAMIDE-PHENYLETHYLAMINES USEFUL AS DOPAMINE RECEPTORS PHARMACIA & UPJOHN COMPANY (US) 1999-11-18 WO claimed
EP-1077935-B1 PHENYLSULFONAMIDE-PHENYLETHYLAMINES USEFUL AS DOPAMINE RECEPTORS UPJOHN CO (US) 2003-10-29 EP disclosed
EP-1077935-A1 PHENYLSULFONAMIDE-PHENYLETHYLAMINES USEFUL AS DOPAMINE RECEPTORS PHARMACIA & UPJOHN COMPANY (US) 2001-02-28 EP disclosed
US-6103766-A SUBSTITUTED OR UNSUBSTITUTED PHENYLSULFONAMIDE-PHENYLAMINE DERIVATIVES USEFUL FOR TREATING THE DISORDERS RELATED TO CENTRAL NERVOUS SYSTEM PHARMACIA & UPJOHN COMPANY (US) 2000-08-15 US disclosed
WO-1999058499-A1 PHENYLSULFONAMIDE-PHENYLETHYLAMINES USEFUL AS DOPAMINE RECEPTORS PHARMACIA & UPJOHN COMPANY (US) 1999-11-18 WO disclosed