SCHEMBL7213470

SCHEMBL7213470

NCCCCCc1cccc(NS(=O)(=O)c2cccc(Cl)c2)c1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.69
PGR P06401 8/20 0.57
GHSR Q92847 2/20 0.53
PKM P14618 1/20 0.51
MAPT P10636 2/20 0.47
LMNA P02545 1/20 0.47
TDP1 Q9NUW8 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
Propane SCHEMBL7213474 0.86 HTR6 (0.70) HTR6PGRGHSRPKMMAPT
SCHEMBL3125892 0.82 HTR6 (1.00) HTR6GHSRPKMMAPT
SCHEMBL7211617 0.77 HTR6 (0.57) HTR6PGRPKMMAPTLMNA
SCHEMBL8442223 0.77 TAAR1 (0.71)
SCHEMBL7206689 0.77 HTR6 (0.63) HTR6GHSRPKM
SCHEMBL1800551 0.75 TAAR1 (0.74)
SCHEMBL17894501 0.75 PGR (0.56) HTR6PGRPKMMAPTLMNA
SCHEMBL30737484 0.74 PGR (0.71) HTR6PGRPKMMAPTLMNA
SCHEMBL16431575 0.74 PGR (0.71) HTR6PGRPKMMAPTLMNA
SCHEMBL3756876 0.74 PGR (1.00) PGRPKMMAPTLMNATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1077935-B1 PHENYLSULFONAMIDE-PHENYLETHYLAMINES USEFUL AS DOPAMINE RECEPTORS UPJOHN CO (US) 2003-10-29 EP 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
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