SCHEMBL9530652

SCHEMBL9530652

CCCCc1noc(C(=O)O)c1Cc1ccc(-c2ccccc2)c(NS(=O)(=O)C(F)(F)F)c1

nearest known ligand 0.43

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.36

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
SCHEMBL9526639 0.91
SCHEMBL9530304 0.89 EDNRA (0.35)
SCHEMBL9526538 0.85 AGTR2 (0.39)
SCHEMBL9754332 0.78 AGTR2 (0.40)
SCHEMBL9526558 0.78 METAP2 (0.34) METAP2
SCHEMBL9753975 0.76 AGTR2 (0.46)
SCHEMBL9530005 0.73 AGTR2 (0.40)
SCHEMBL9151935 0.72
SCHEMBL9529961 0.72 AGTR2 (0.57)
SCHEMBL9527008 0.71 AGTR2 (0.50)

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
EP-0523141-A4 SUBSTITUTED PYRAZOLES, ISOXAZOLES AND ISOTHIAZOLES 1993-04-21 EP disclosed
EP-0523141-A1 SUBSTITUTED PYRAZOLES, ISOXAZOLES AND ISOTHIAZOLES MERCK & CO. INC. (US) 1993-01-20 EP disclosed