SCHEMBL8676709

SCHEMBL8676709

CC(C)NC(=O)/C=C1\c2ccccc2N(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)CCC1(F)F

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 16/20 0.72
AVPR1A P37288 13/20 0.72
AVPR1B P47901 5/20 0.57
OXTR P30559 2/20 0.57

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
SCHEMBL8676713 1.00 AVPR2 (0.72) AVPR2AVPR1AAVPR1BOXTR
SCHEMBL9030175 1.00 AVPR2 (0.72) AVPR2AVPR1AAVPR1BOXTR
SCHEMBL9029253 0.91 AVPR2 (0.73) AVPR2AVPR1AAVPR1BOXTR
SCHEMBL9029248 0.91 AVPR2 (0.73) AVPR2AVPR1AAVPR1BOXTR
SCHEMBL9028397 0.90 AVPR1A (0.73) AVPR2AVPR1AAVPR1BOXTR
SCHEMBL9028332 0.90 AVPR1A (0.73) AVPR2AVPR1AAVPR1BOXTR
SCHEMBL8670855 0.90 AVPR1A (0.73) AVPR2AVPR1AAVPR1BOXTR
SCHEMBL9028905 0.89 AVPR2 (0.70) AVPR2AVPR1AAVPR1BOXTR
SCHEMBL9028912 0.89 AVPR2 (0.70) AVPR2AVPR1AAVPR1BOXTR
SCHEMBL9029668 0.88 AVPR1A (0.71) AVPR2AVPR1AAVPR1BOXTR

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
US-5710150-A ARGININE VASOPRESSIN ANTAGONISTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1998-01-20 US claimed
EP-0716083-A1 BENZAZEPINE DERIVATIVE, PHARMACEUTICAL COMPOSITION CONTAINING THE SAME, AND INTERMEDIATE FOR THE SAME YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1996-06-12 EP claimed
EP-0716083-A1 BENZAZEPINE DERIVATIVE, PHARMACEUTICAL COMPOSITION CONTAINING THE SAME, AND INTERMEDIATE FOR THE SAME YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1996-06-12 EP disclosed