SCHEMBL16333263

SCHEMBL16333263

Cc1onc(-c2cccnc2)c1COc1ccc(C(=O)O)cn1

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 19/20 0.81
ITGA5 P08648 1/20 0.69
GABRA1 P14867 1/20 0.64

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
SCHEMBL108791 0.90 GABRA5 (0.82) GABRA5
SCHEMBL2922622 0.90 GABRA5 (1.00) GABRA5ITGA5
SCHEMBL2923151 0.88 GABRA5 (0.78) GABRA5
SCHEMBL20241113 0.87 GABRA1 (0.82) GABRA5GABRA1
SCHEMBL30592788 0.87 GABRA1 (0.82) GABRA5GABRA1
SCHEMBL2928355 0.87 GABRA5 (1.00) GABRA5ITGA5GABRA1
SCHEMBL16333644 0.85 GABRA5 (0.77) GABRA5
SCHEMBL30592827 0.85 GABRA5 (0.77) GABRA5GABRA1
SCHEMBL20241120 0.85 GABRA5 (0.77) GABRA5GABRA1
SCHEMBL2927381 0.85 GABRA5 (1.00) GABRA5ITGA5GABRA1

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-2227467-B1 ISOXAZOLO-PYRIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2014-12-31 EP disclosed