SCHEMBL7984926

SCHEMBL7984926

CC(=O)O[C@@H]1C[C@H]2CN(C(=O)c3ccc(NC(=O)c4ccccc4-c4ccc(C)cc4)cc3)c3ccccc3CN2C1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 19/20 0.59
AVPR1A P37288 10/20 0.59
CYP2C9 P11712 1/20 0.54
OXTR P30559 1/20 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
SCHEMBL7981463 1.00 AVPR2 (0.59) AVPR2AVPR1ACYP2C9OXTR
SCHEMBL7985315 0.94 AVPR2 (0.66) AVPR2AVPR1AOXTR
SCHEMBL7978654 0.94 AVPR2 (0.66) AVPR2AVPR1AOXTR
SCHEMBL7977960 0.88 AVPR2 (0.63) AVPR2AVPR1ACYP2C9OXTR
SCHEMBL7981726 0.88 AVPR2 (0.63) AVPR2AVPR1ACYP2C9OXTR
SCHEMBL7981742 0.87 AVPR2 (0.51) AVPR2AVPR1ACYP2C9OXTR
SCHEMBL7979010 0.87 AVPR2 (0.51) AVPR2AVPR1ACYP2C9OXTR
SCHEMBL7981447 0.87 AVPR2 (0.62) AVPR2AVPR1ACYP2C9OXTR
SCHEMBL8135528 0.86 AVPR2 (0.63) AVPR2AVPR1ACYP2C9OXTR
SCHEMBL7984873 0.85 AVPR2 (0.49) AVPR2AVPR1ACYP2C9OXTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6225306-B1 PYRROLO(1,2A)QUINOXALINES WAKAMOTO PHARMACEUTICAL CO., LTD. (JP) 2001-05-01 US disclosed