SCHEMBL20273659

SCHEMBL20273659

NC(=O)C1CCCC1Nc1nc(-c2cccnc2)nc2ccc(C3CC=CC(F)=C3F)cc12

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 17/20 0.44
▸ PDE5A O76074 2/20 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
SCHEMBL20273698 0.86 GBA1 (0.44) GBA1PDE5A
SCHEMBL14475095 0.79 GBA1 (0.47) GBA1
SCHEMBL14475176 0.79 GBA1 (0.46) GBA1PDE5A
SCHEMBL14475218 0.76 ABCG2 (0.52) GBA1
SCHEMBL14474516 0.76 ABCG2 (0.52) GBA1
SCHEMBL14475596 0.76 ABCG2 (0.52) GBA1
SCHEMBL16184658 0.70 GBA1 (0.42) GBA1
SCHEMBL14474167 0.70 GBA1 (0.42) GBA1
SCHEMBL16184520 0.69 GBA1 (0.41) GBA1
SCHEMBL20273732 0.69 ABCG2 (0.51) GBA1

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-3056207-B1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMA CO LTD (JP) 2018-06-20 — — EP disclosed
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