SCHEMBL8718172

SCHEMBL8718172

Cc1ccccc1C(=O)Nc1ccc(C(=O)N2c3ccc(F)cc3C(O)(CO)CCC2Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 11/20 0.43
AVPR1A P37288 11/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL8716101 0.90 AVPR2 (0.49) AVPR2AVPR1A
SCHEMBL8630548 0.82 HSD11B1 (0.44) AVPR2AVPR1A
SCHEMBL8718588 0.80 AVPR2 (0.54) AVPR2AVPR1AMEN1KMT2A
SCHEMBL8718169 0.76 AVPR2 (0.54) AVPR2AVPR1A
Hydrochloric Acid SCHEMBL8629997 0.76 AVPR1A (0.41) AVPR2AVPR1A
SCHEMBL8712329 0.72 AVPR2 (0.68) AVPR2AVPR1A
SCHEMBL8719656 0.72 AVPR2 (0.66) AVPR2AVPR1A
SCHEMBL7351794 0.72 AVPR1A (0.62) AVPR2AVPR1A
SCHEMBL8716058 0.72 AVPR1A (0.68) AVPR2AVPR1A
SCHEMBL8712538 0.71 AVPR2 (0.51) AVPR2AVPR1A

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-5753677-A Benzoheterocyclic compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-05-19 US claimed