SCHEMBL881978

SCHEMBL881978

C=CN/C=C(\C)c1nc(C2(c3ccc(/C(C=C)=C/N=C(C)C)nc3)CCC2)no1

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 20/20 0.37

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
SCHEMBL881991 0.79 ALOX5AP (0.53) ALOX5AP
SCHEMBL881983 0.77 ALOX5AP (0.58) ALOX5AP
SCHEMBL881980 0.77 ALOX5AP (0.56) ALOX5AP
SCHEMBL881987 0.75 ALOX5AP (0.41) ALOX5AP
SCHEMBL881981 0.74 ALOX5AP (0.59) ALOX5AP
SCHEMBL881646 0.61 ALOX5AP (0.63) ALOX5AP
SCHEMBL22701274 0.57 KDM4E (0.46)
SCHEMBL877399 0.57 ALOX5AP (0.56) ALOX5AP
SCHEMBL11996540 0.56 ALOX5AP (0.58) ALOX5AP
SCHEMBL876447 0.56 ALOX5AP (0.58) ALOX5AP

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
WO-2012040139-A1 OXADIAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-03-29 WO disclosed