SCHEMBL6965585

SCHEMBL6965585

Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3CCC(=O)N(CC(=O)N4CCN(C)CC4)c4ccccc43)cc2O)cc1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 11/20 0.51
AVPR1B P47901 9/20 0.51
AVPR2 P30518 17/20 0.48
OXTR P30559 2/20 0.40

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
SCHEMBL6957855 0.91 AVPR1A (0.54) AVPR1AAVPR1BAVPR2
SCHEMBL6960416 0.90 AVPR1A (0.55) AVPR1AAVPR1BAVPR2OXTR
SCHEMBL8961667 0.89 AVPR2 (0.47) AVPR1AAVPR1BAVPR2OXTR
SCHEMBL6701281 0.89 AVPR2 (0.56) AVPR1AAVPR1BAVPR2OXTR
SCHEMBL7134697 0.87 AVPR2 (0.52) AVPR1AAVPR1BAVPR2OXTR
SCHEMBL6972082 0.87 AVPR1A (0.52) AVPR1AAVPR1BAVPR2
SCHEMBL6970903 0.87 AVPR2 (0.46) AVPR1AAVPR1BAVPR2OXTR
SCHEMBL6971518 0.86 AVPR2 (0.56) AVPR1AAVPR1BAVPR2
SCHEMBL6971215 0.86 AVPR2 (0.45) AVPR1AAVPR1BAVPR2OXTR
SCHEMBL6970484 0.86 AVPR2 (0.55) AVPR1AAVPR1BAVPR2OXTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0620216-B1 Benzamide derivatives and their use as vasopressin antagonists FUJISAWA PHARMACEUTICAL CO (JP) 2003-01-08 EP disclosed
US-5521170-A VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-05-28 US disclosed
EP-0620216-A1 Benzamide derivatives and their use as vasopressin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-10-19 EP disclosed