SCHEMBL5256233

SCHEMBL5256233

CCCc1c(Cn2ccnc2-c2cccc(F)n2)ncn2c(OC(=O)OCC)cnc12

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 1/20 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
SCHEMBL4765440 0.89 TGFBR1 (0.35) —
SCHEMBL5258600 0.87 OPRD1 (0.30) OPRD1
SCHEMBL4763292 0.81 KDM4E (0.40) OPRD1
SCHEMBL4771399 0.80 TGFBR1 (0.37) —
SCHEMBL4763649 0.79 — —
SCHEMBL4766453 0.79 CYP3A4 (0.32) —
SCHEMBL4770965 0.78 TGFBR1 (0.33) —
SCHEMBL4767703 0.78 PDE10A (0.32) —
SCHEMBL4770139 0.77 — —
SCHEMBL4790982 0.77 — —

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-1648899-B1 IMIDAZO-PYRIMIDINES AND TRIAZOLO-PYRIMIDINES: BENZODIAZEPINE RECEPTOR LIGANDS NEUROGEN CORP (US) 2007-01-03 — — EP claimed
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