SCHEMBL9778237

SCHEMBL9778237

CC(c1ccc2c(c1)Sc1cc(C#N)ccc1O2)N(O)C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 15/20 0.44

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
SCHEMBL9778270 0.84 ALOX5 (0.51) ALOX5
SCHEMBL9778210 0.83 ALOX5 (0.58) ALOX5
SCHEMBL9778263 0.83 ALOX5 (0.51) ALOX5
SCHEMBL9778282 0.72 MAPT (0.42)
SCHEMBL9778290 0.68 ALOX5 (0.52) ALOX5
SCHEMBL11550196 0.68 SNCA (0.38)
SCHEMBL9778320 0.68 ALOX5 (0.51) ALOX5
SCHEMBL9774466 0.67 ALOX5 (0.74) ALOX5
SCHEMBL9778281 0.67 ALOX5 (0.50) ALOX5
SCHEMBL23775813 0.65 LMNA (0.38)

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-5036067-A Enzyme inhibotors MERCK & CO., INC. (US) 1991-07-30 US claimed
US-5036067-A Enzyme inhibotors MERCK & CO., INC. (US) 1991-07-30 US disclosed