SCHEMBL19265166

SCHEMBL19265166

NC(=O)OCCC(NC(=O)Cn1nc(-c2ccc(Cl)cc2)n(CCC(F)(F)F)c1=O)c1cccc(Cl)c1Cl

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AVPR2 P30518 20/20 0.65
▸ AVPR1A P37288 20/20 0.65

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
SCHEMBL3447263 0.93 AVPR2 (0.65) AVPR2AVPR1A
SCHEMBL13158418 0.91 AVPR2 (0.65) AVPR2AVPR1A
SCHEMBL19265297 0.90 AVPR2 (0.62) AVPR2AVPR1A
SCHEMBL19265180 0.90 AVPR2 (0.61) AVPR2AVPR1A
SCHEMBL19265099 0.89 AVPR2 (0.63) AVPR2AVPR1A
SCHEMBL19265195 0.89 AVPR2 (0.61) AVPR2AVPR1A
SCHEMBL3447958 0.89 AVPR2 (0.72) AVPR2AVPR1A
SCHEMBL19265188 0.88 AVPR2 (0.62) AVPR2AVPR1A
SCHEMBL414659 0.88 AVPR2 (0.66) AVPR2AVPR1A
SCHEMBL19265334 0.88 AVPR2 (0.71) AVPR2AVPR1A

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-2408751-B1 Substituted 2-acetamido-5-aryl-1,2,4-triazolones and use thereof BAYER IP GMBH (DE) 2017-08-23 — — EP disclosed
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