SCHEMBL6140337

SCHEMBL6140337

COc1ccc(S(=O)(=O)N2C(=O)C(c3cccc(OC)c3OC)(N3CCCC3C(=O)N(C)C)c3cc(Cl)ccc32)c(OC)c1

nearest known ligand 0.79

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AVPR1B P47901 20/20 0.79
OXTR P30559 11/20 0.79
AVPR1A P37288 11/20 0.79
AVPR2 P30518 3/20 0.69
GPR65 Q8IYL9 1/20 0.69

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
SCHEMBL4590483 1.00 AVPR1B (0.79) AVPR1BOXTRAVPR1AAVPR2GPR65
SCHEMBL6140538 0.94 AVPR1B (0.82) AVPR1BOXTRAVPR1AAVPR2GPR65
SCHEMBL4590067 0.94 AVPR1B (0.82) AVPR1BOXTRAVPR1AAVPR2GPR65
SCHEMBL4590080 0.93 AVPR1B (0.79) AVPR1BOXTRAVPR1AAVPR2GPR65
SCHEMBL6140940 0.93 AVPR1B (0.79) AVPR1BOXTRAVPR1AAVPR2GPR65
SCHEMBL6139834 0.91 AVPR1B (0.86) AVPR1BOXTRAVPR1AAVPR2GPR65
SCHEMBL4590182 0.91 AVPR1B (0.86) AVPR1BOXTRAVPR1AAVPR2GPR65
SCHEMBL4590365 0.91 AVPR1B (0.80) AVPR1BOXTRAVPR1AAVPR2GPR65
SCHEMBL6140323 0.91 AVPR1B (0.80) AVPR1BOXTRAVPR1AAVPR2GPR65
SCHEMBL6140418 0.90 AVPR1B (0.75) AVPR1BOXTRAVPR1AAVPR2GPR65

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
US-6864277-B2 1,3-dihydro-2H-indol-2-one derivatives, method for preparing same and pharmaceutical compositions containing them SANOFI-SYNTHELABO (FR) 2005-03-08 US claimed
US-6864277-B2 1,3-dihydro-2H-indol-2-one derivatives, method for preparing same and pharmaceutical compositions containing them SANOFI-SYNTHELABO (FR) 2005-03-08 US disclosed