SCHEMBL18091973

SCHEMBL18091973

Cc1nc(CCc2c(-c3ccc(F)cn3)noc2C)sc1OC(=O)NC1CC1

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 19/20 0.44
ITGA5 P08648 2/20 0.41

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
SCHEMBL18092049 0.95 GABRA5 (0.47) GABRA5ITGA5
SCHEMBL18092022 0.89 GABRA5 (0.47) GABRA5
SCHEMBL18092027 0.89 GABRA5 (0.44) GABRA5
SCHEMBL18091986 0.88 GABRA5 (0.47) GABRA5ITGA5
SCHEMBL18092030 0.87 GABRA5 (0.52) GABRA5
SCHEMBL18091997 0.87 GABRA5 (0.46) GABRA5
SCHEMBL18092029 0.87 GABRA5 (0.52) GABRA5ITGA5
SCHEMBL18092009 0.86 GABRA5 (0.53) GABRA5
SCHEMBL286022 0.86 GABRA5 (0.46) GABRA5ITGA5
SCHEMBL18092056 0.85 GABRA5 (0.55) GABRA5

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-2427459-B1 ISOXAZOLE-THIAZOLE DERIVATIVES AS GABA A RECEPTOR INVERSE AGONISTS FOR USE IN THE TREATMENT OF COGNITIVE DISORDERS HOFFMANN LA ROCHE (CH) 2016-09-28 EP claimed