SCHEMBL4797955

SCHEMBL4797955

CC(=O)N1Cc2cc(-c3cccc(NS(C)(=O)=O)c3)ccc2CCc2cc(Cl)ccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 19/20 1.00
TRIM24 O15164 1/20 0.52

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
SCHEMBL4800947 0.96 HSD17B3 (0.92) HSD17B3TRIM24
SCHEMBL4798041 0.87 HSD17B3 (0.76) HSD17B3TRIM24
SCHEMBL4801286 0.84 HSD17B3 (1.00) HSD17B3
SCHEMBL4798118 0.84 HSD17B3 (1.00) HSD17B3
SCHEMBL4799790 0.84 HSD17B3 (0.72) HSD17B3
SCHEMBL4795099 0.83 HSD17B3 (0.73) HSD17B3
SCHEMBL4801462 0.82 HSD17B3 (0.76) HSD17B3
SCHEMBL4796982 0.81 HSD17B3 (0.81) HSD17B3
SCHEMBL4800298 0.81 HSD17B3 (1.00) HSD17B3
SCHEMBL4799873 0.81 HSD17B3 (1.00) HSD17B3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7417040-B2 Fused tricyclic compounds as inhibitors of 17β-hydroxysteroid dehydrogenase 3 BRISTOL-MYERS SQUIBB COMPANY (US) 2008-08-26 US disclosed