SCHEMBL8961674

SCHEMBL8961674

Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3CCCC(=NOCC(=O)N4CCN(C)CC4)c4ccccc43)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 13/20 0.61
AVPR1A P37288 5/20 0.53
OXTR P30559 1/20 0.53
AVPR1B P47901 3/20 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
SCHEMBL8961671 1.00 AVPR2 (0.61) AVPR2AVPR1AOXTRAVPR1B
SCHEMBL8961740 0.90 AVPR2 (0.61) AVPR2AVPR1AOXTRAVPR1B
SCHEMBL9414268 0.90 AVPR2 (0.61) AVPR2AVPR1AOXTRAVPR1B
SCHEMBL8961679 0.88 AVPR2 (0.64) AVPR2AVPR1AOXTRAVPR1B
SCHEMBL8961678 0.88 AVPR2 (0.64) AVPR2AVPR1AOXTRAVPR1B
SCHEMBL6971545 0.82 AVPR2 (0.68) AVPR2AVPR1AOXTRAVPR1B
SCHEMBL6972323 0.80 AVPR2 (0.80) AVPR2AVPR1AOXTR
SCHEMBL6989484 0.80 AVPR2 (0.70) AVPR2AVPR1AOXTRAVPR1B
SCHEMBL6970066 0.79 AVPR2 (0.55) AVPR2AVPR1AOXTRAVPR1B
SCHEMBL6965024 0.79 AVPR2 (0.57) AVPR2AVPR1AOXTRAVPR1B

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-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