SCHEMBL2499289

SCHEMBL2499289

COc1ccc(S(=O)(=O)N2C(=O)C(NC(=O)Oc3ccccc3)(c3ccccc3OC)c3cc(Cl)ccc32)c(OC(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AVPR1B P47901 20/20 0.49
AVPR1A P37288 7/20 0.49
OXTR P30559 7/20 0.49
AVPR2 P30518 3/20 0.49
GPR65 Q8IYL9 1/20 0.49

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
SCHEMBL5678532 0.93 AVPR1B (0.55) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL5675833 0.89 AVPR1B (0.52) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL5674427 0.88 AVPR1B (0.51) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL5675270 0.88 AVPR1B (0.50) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL2493392 0.88 AVPR1B (0.50) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL2495355 0.86 AVPR1B (0.49) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL2498777 0.85 AVPR1B (0.54) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL2495093 0.85 AVPR1B (0.54) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL5674074 0.85 AVPR1B (0.42) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL2497275 0.84 AVPR1B (0.53) AVPR1BAVPR1AOXTRAVPR2GPR65

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
US-8030499-B2 1,3-dihydro-2H-indole-2-one compound and pyrrolidine-2-one compound fused with aromatic heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-10-04 US disclosed