SCHEMBL166641

SCHEMBL166641

O=C(Cn1nc(-c2ccc(Cl)cc2)n(CC(O)C(F)(F)F)c1=O)N[C@H](CO)Cc1cccc(C(F)(F)F)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 20/20 1.00
AVPR1A P37288 20/20 1.00

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
SCHEMBL15206271 1.00 AVPR2 (1.00) AVPR2AVPR1A
SCHEMBL256567 1.00 AVPR2 (1.00) AVPR2AVPR1A
SCHEMBL16673914 0.92 AVPR2 (0.84) AVPR2AVPR1A
SCHEMBL16673696 0.92 AVPR2 (0.84) AVPR2AVPR1A
SCHEMBL257015 0.90 AVPR2 (0.81) AVPR2AVPR1A
SCHEMBL15206330 0.90 AVPR2 (0.81) AVPR2AVPR1A
SCHEMBL15206329 0.90 AVPR2 (0.81) AVPR2AVPR1A
SCHEMBL419513 0.86 AVPR2 (0.77) AVPR2AVPR1A
SCHEMBL12057196 0.84 AVPR2 (0.79) AVPR2AVPR1A
SCHEMBL19244814 0.83 AVPR2 (0.73) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2619188-A1 SUBSTITUTED N-PHENETHYLTRIAZOLONEACETAMIDES AND USE THEREOF Bayer Intellectual Property GmbH (DE) 2013-07-31 EP disclosed
WO-2012028644-A1 SUBSTITUTED N-PHENETHYLTRIAZOLONEACETAMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-03-08 WO disclosed