SCHEMBL6626802

SCHEMBL6626802

CCOC(=O)NC(=O)NCc1ccc(C(=O)N2CCCCc3ccccc32)cc1C

nearest known ligand 0.79

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 20/20 0.79

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
SCHEMBL5510948 0.89 AVPR2 (1.00) AVPR2
SCHEMBL6626800 0.87 AVPR2 (0.84) AVPR2
SCHEMBL6625979 0.86 AVPR2 (0.81) AVPR2
SCHEMBL5267294 0.85 AVPR2 (1.00) AVPR2
SCHEMBL5232864 0.84 AVPR2 (1.00) AVPR2
SCHEMBL5515673 0.84 AVPR2 (1.00) AVPR2
SCHEMBL5232539 0.84 AVPR2 (1.00) AVPR2
SCHEMBL5234582 0.83 AVPR2 (0.75) AVPR2
SCHEMBL5234495 0.83 AVPR2 (0.78) AVPR2
SCHEMBL6628917 0.83 AVPR2 (1.00) AVPR2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1226122-B1 BICYCLIC VASOPRESSIN AGONISTS FERRING BV (NL) 2004-12-15 EP claimed
EP-1226122-B1 BICYCLIC VASOPRESSIN AGONISTS FERRING BV (NL) 2004-12-15 EP disclosed
EP-1226122-A1 BICYCLIC VASOPRESSIN AGONISTS Ferring BV (NL) 2002-07-31 EP disclosed
WO-2001029005-A1 BICYCLIC VASOPRESSIN AGONISTS FERRING BV (NL) 2001-04-26 WO disclosed