SCHEMBL7329412

SCHEMBL7329412

N#CCNC(=O)C(Sc1nc2cc(Cl)ccc2s1)c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 18/20 0.71
MEN1 O00255 1/20 0.49
USP2 O75604 1/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
HTT P42858 1/20 0.49
KMT2A Q03164 1/20 0.49
HSD17B10 Q99714 1/20 0.49
ALOX5 P09917 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
SCHEMBL7331473 0.88 PPARA (0.72) PPARAALOX5
SCHEMBL7334028 0.87 PPARA (0.71) PPARAALOX5
SCHEMBL7321487 0.86 PPARA (0.77) PPARAMEN1LMNAMAPTKMT2A
SCHEMBL7333757 0.85 PPARA (0.67) PPARAALOX5
SCHEMBL2837046 0.85 PPARA (0.79) PPARAMEN1MAPTKMT2AALOX5
SCHEMBL7331187 0.83 PPARA (1.00) PPARAMEN1MAPTKMT2AHSD17B10
SCHEMBL7331454 0.81 PPARA (0.72) PPARAALOX5
SCHEMBL7325872 0.81 PPARA (0.82) PPARAMEN1MAPTKMT2AHSD17B10
SCHEMBL7324266 0.81 PPARA (0.82) PPARAMEN1USP2LMNAMAPT
SCHEMBL7334889 0.81 PPARA (0.62) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4567267-A α-Phenyl-2-(aza)benzothiazolylthioglycolic acids and derivatives thereof AMERICAN HOME PRODUCTS CORPORATION (US) 1986-01-28 US claimed
US-4567267-A α-Phenyl-2-(aza)benzothiazolylthioglycolic acids and derivatives thereof AMERICAN HOME PRODUCTS CORPORATION (US) 1986-01-28 US disclosed