SCHEMBL686543

SCHEMBL686543

Cc1[nH]nc(N)c1-c1nc2ccc(OC(=O)O)cc2s1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ILK Q13418 20/20 0.73

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
SCHEMBL687457 0.89 ILK (0.74) ILK
SCHEMBL686406 0.85 ILK (1.00) ILK
SCHEMBL686542 0.84 ILK (1.00) ILK
SCHEMBL686482 0.80 ILK (1.00) ILK
SCHEMBL686711 0.77 ILK (1.00) ILK
SCHEMBL687024 0.77 ILK (1.00) ILK
SCHEMBL2165994 0.77 ILK (0.83) ILK
SCHEMBL686963 0.77 ILK (1.00) ILK
SCHEMBL687221 0.76 ILK (0.53) ILK
SCHEMBL686928 0.76 ILK (1.00) ILK

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
EP-1542997-B1 PYRAZOLYLBENZOTHIAZOLE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS DERMIRA CANADA INC (CA) 2012-02-29 EP claimed