SCHEMBL28027648

SCHEMBL28027648

CC(=O)Oc1ccc(Cn2nc(-c3ccc(Cl)cc3)n(C[C@H](O)C(F)(F)F)c2=O)cc1-c1ccccc1C(F)(F)F

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 20/20 0.62
AVPR1A P37288 20/20 0.62

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
SCHEMBL18783441 0.93 AVPR2 (0.63) AVPR2AVPR1A
SCHEMBL2442901 0.87 AVPR2 (0.62) AVPR2AVPR1A
SCHEMBL6929026 0.86 AVPR2 (0.69) AVPR2AVPR1A
SCHEMBL6928396 0.85 AVPR2 (0.70) AVPR2AVPR1A
SCHEMBL18783450 0.85 AVPR2 (0.71) AVPR2AVPR1A
SCHEMBL2444038 0.84 AVPR2 (0.60) AVPR2AVPR1A
SCHEMBL6928820 0.83 AVPR2 (0.84) AVPR2AVPR1A
SCHEMBL2438361 0.83 AVPR2 (0.85) AVPR2AVPR1A
SCHEMBL18783454 0.82 AVPR2 (0.68) AVPR2AVPR1A
SCHEMBL6929263 0.80 AVPR2 (0.68) 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
CN-103189363-B Biaryl linked aryl triazolones and uses thereof BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-07-29 CN disclosed