SCHEMBL7206707

SCHEMBL7206707

CCCNCCc1ccc(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 3/20 0.53
HDAC8 Q9BY41 3/20 0.53
HDAC3 O15379 2/20 0.53
HDAC4 P56524 2/20 0.53
HDAC7 Q8WUI4 2/20 0.53
HDAC2 Q92769 2/20 0.53
HDAC10 Q969S8 2/20 0.53
HDAC11 Q96DB2 2/20 0.53
HDAC6 Q9UBN7 2/20 0.53
HDAC9 Q9UKV0 2/20 0.53
HDAC5 Q9UQL6 2/20 0.53
FFAR4 Q5NUL3 3/20 0.51
FFAR1 O14842 1/20 0.51
TP53 P04637 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ADRB2 P07550 9/20 0.48
ADRB1 P08588 9/20 0.48
ADRB3 P13945 9/20 0.48
UCHL1 P09936 1/20 0.48
RORC P51449 1/20 0.47

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
SCHEMBL7208087 0.84 FFAR4 (0.54) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL2472519 0.84 HDAC1 (0.50) HDAC1HDAC8HDAC3HDAC4HDAC7
Propane SCHEMBL7208561 0.83 HTR6 (0.58) HDAC1HDAC8HDAC3HDAC4HDAC7
Hydrochloric Acid SCHEMBL4922816 0.83 HDAC1 (0.49) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL2467867 0.82 GHSR (0.52) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL2470474 0.81 HDAC1 (0.50) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL2492550 0.81 HDAC1 (0.50) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL2470476 0.81 HDAC1 (0.50) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL7208101 0.80 PRMT1 (0.62) FFAR4FFAR1ADRB2ADRB1ADRB3
SCHEMBL7208126 0.80 ADRB2 (0.54) FFAR4FFAR1SMN1; SMN2ADRB2ADRB1

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