SCHEMBL7325252

SCHEMBL7325252

O=C(O)C(Sc1nc2cc(Cl)ccc2s1)c1ccc(Cl)cc1

nearest known ligand 0.88

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.88
SMN1; SMN2 Q16637 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
ALOX5 P09917 2/20 0.48

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
SCHEMBL7331187 0.94 PPARA (1.00) PPARASMN1; SMN2NPSR1ALOX5
SCHEMBL11374053 0.93 PPARA (0.80) PPARASMN1; SMN2NPSR1ALOX5
SCHEMBL11359594 0.91 PPARA (0.82) PPARASMN1; SMN2NPSR1ALOX5
SCHEMBL7324319 0.89 PPARA (0.70) PPARASMN1; SMN2NPSR1ALOX5
SCHEMBL7324522 0.87 PPARA (0.76) PPARASMN1; SMN2
SCHEMBL11364057 0.85 PPARA (0.79) PPARASMN1; SMN2NPSR1ALOX5
SCHEMBL7325872 0.84 PPARA (0.82) PPARASMN1; SMN2NPSR1ALOX5
SCHEMBL7324266 0.84 PPARA (0.82) PPARASMN1; SMN2NPSR1
SCHEMBL11368265 0.84 PPARA (0.82) PPARA
SCHEMBL2837046 0.82 PPARA (0.79) PPARAALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0067685-B1 ALPHA-PHENYL-2-(AZA)BENZOTHIAZOLYLTHIOGLYCOLIC ACIDS AND DERIVATIVES THEREOF AMERICAN HOME PRODUCTS CORPORATION (US) 1986-11-05 EP claimed
US-4567267-A α-Phenyl-2-(aza)benzothiazolylthioglycolic acids and derivatives thereof AMERICAN HOME PRODUCTS CORPORATION (US) 1986-01-28 US claimed
US-4367233-A ALPHA-PHENYL-2-/AZA/BENZOTHIAZOYLTHIOGLYCOLIC ACIDS AMERICAN HOME PRODUCTS CORPORATION (US) 1983-01-04 US claimed
EP-0067685-A1 Alpha-phenyl-2-(aza)benzothiazolylthioglycolic acids and derivatives thereof AMERICAN HOME PRODUCTS CORPORATION (US) 1982-12-22 EP claimed
EP-0067685-B1 ALPHA-PHENYL-2-(AZA)BENZOTHIAZOLYLTHIOGLYCOLIC ACIDS AND DERIVATIVES THEREOF AMERICAN HOME PRODUCTS CORPORATION (US) 1986-11-05 EP disclosed
US-4567267-A α-Phenyl-2-(aza)benzothiazolylthioglycolic acids and derivatives thereof AMERICAN HOME PRODUCTS CORPORATION (US) 1986-01-28 US disclosed
US-4367233-A ALPHA-PHENYL-2-/AZA/BENZOTHIAZOYLTHIOGLYCOLIC ACIDS AMERICAN HOME PRODUCTS CORPORATION (US) 1983-01-04 US disclosed
EP-0067685-A1 Alpha-phenyl-2-(aza)benzothiazolylthioglycolic acids and derivatives thereof AMERICAN HOME PRODUCTS CORPORATION (US) 1982-12-22 EP disclosed