SCHEMBL18091968

SCHEMBL18091968

CCCCc1noc(C)c1CCc1nc(C)c(OC(=O)NC(C)CO)s1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 1/20 0.31
GABRA5 P31644 3/20 0.30

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
SCHEMBL18091966 1.00 L3MBTL1 (0.33) L3MBTL1ALDH1A1GABRA5
SCHEMBL18092040 1.00 L3MBTL1 (0.33) L3MBTL1ALDH1A1GABRA5
SCHEMBL18091987 0.92 L3MBTL1 (0.33) L3MBTL1ALDH1A1
SCHEMBL18092080 0.92 L3MBTL1 (0.34) L3MBTL1ALDH1A1
SCHEMBL18092077 0.85 L3MBTL1 (0.33) L3MBTL1ALDH1A1GABRA5
SCHEMBL286081 0.84 ZAP70 (0.35) L3MBTL1ALDH1A1GABRA5
SCHEMBL285587 0.84 ZAP70 (0.35) L3MBTL1ALDH1A1GABRA5
SCHEMBL286242 0.84 ZAP70 (0.35) L3MBTL1ALDH1A1GABRA5
SCHEMBL18091974 0.83 GABRA5 (0.35) L3MBTL1ALDH1A1GABRA5
SCHEMBL18092035 0.83 GABRA5 (0.35) L3MBTL1ALDH1A1GABRA5

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