SCHEMBL17058043

SCHEMBL17058043

Cc1cc(F)cc(-n2ncc(N3CCN(SCc4ccc5nc(CO)oc5c4)CC3)c(OCC3(C)CC3)c2=O)c1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ NPBWR1 P48145 1/20 0.34

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
SCHEMBL11946301 0.83 MAPT (0.33) —
SCHEMBL17058025 0.81 SLC2A1 (0.31) —
SCHEMBL17058345 0.80 RAB9A (0.34) NPBWR1
SCHEMBL11946296 0.78 MAPT (0.33) —
SCHEMBL17058018 0.78 — —
SCHEMBL17058268 0.78 — —
SCHEMBL11946293 0.76 MAPT (0.34) —
SCHEMBL11946297 0.76 MAPT (0.33) —
SCHEMBL11946290 0.76 MAPT (0.32) —
SCHEMBL17058272 0.76 NPSR1 (0.36) NPBWR1

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-2137179-B1 PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS MERCK SHARP & DOHME (US) 2015-09-02 — — EP disclosed
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