SCHEMBL5696372

SCHEMBL5696372

COc1ccc(S(=O)(=O)N2C(=O)C(c3cccnc3OC)(N3CCC(F)(F)C[C@H]3C(=O)ON(C)C)c3cc(Cl)ccc32)c(OC)c1

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AVPR1B P47901 20/20 0.71
AVPR1A P37288 7/20 0.71
OXTR P30559 7/20 0.71
AVPR2 P30518 3/20 0.67
GPR65 Q8IYL9 1/20 0.54

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
SCHEMBL1464433 0.93 AVPR1B (0.81) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL1464434 0.93 AVPR1B (0.81) AVPR1BAVPR1AOXTRAVPR2GPR65
Dimethylamine SCHEMBL5696375 0.90 AVPR1B (0.69) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL5695764 0.87 AVPR1B (0.75) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL1465204 0.86 AVPR1B (0.79) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL1465203 0.86 AVPR1B (0.79) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL1465080 0.85 AVPR1B (0.93) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL1465081 0.85 AVPR1B (0.93) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL1464480 0.84 AVPR1B (0.85) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL1465239 0.83 AVPR1B (1.00) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1667993-A1 HETEROARYL-SUBSTITUTED 1,3-DIHYDROINDOL-2-ONE DERIVATIVES AND MEDICAMENTS CONTAINING THEM Abbott GmbH & Co. KG (DE) 2006-06-14 EP disclosed
WO-2005030755-A1 HETEROARYL-SUBSTITUTED 1,3-DIHYDROINDOL-2-ONE DERIVATIVES AND MEDICAMENTS CONTAINING THEM ABBOTT GMBH & CO. KG (DE) 2005-04-07 WO disclosed