SCHEMBL2929908

SCHEMBL2929908

Cc1cc(C(=O)N2Cc3cccn3Cc3ccccc32)ccc1CNC(=O)N1CC[CH]c2cccc(F)c21

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 10/20 0.59
OXTR P30559 1/20 0.55
AVPR1A P37288 8/20 0.48

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
SCHEMBL1346112 0.88 AVPR2 (0.63) AVPR2OXTRAVPR1A
SCHEMBL2929911 0.86 AVPR2 (0.59) AVPR2OXTRAVPR1A
SCHEMBL1344819 0.85 AVPR2 (0.60) AVPR2OXTRAVPR1A
SCHEMBL2930335 0.83 AVPR2 (0.59) AVPR2OXTRAVPR1A
SCHEMBL1346201 0.82 AVPR2 (0.57) AVPR2OXTRAVPR1A
SCHEMBL1345989 0.82 AVPR2 (0.54) AVPR2OXTRAVPR1A
SCHEMBL1345991 0.82 AVPR2 (0.54) AVPR2OXTRAVPR1A
SCHEMBL1346491 0.81 AVPR2 (0.58) AVPR2OXTRAVPR1A
SCHEMBL1346294 0.81 AVPR2 (0.56) AVPR2OXTRAVPR1A
SCHEMBL1346750 0.81 AVPR2 (0.56) AVPR2OXTRAVPR1A

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
EP-1778677-B1 HETEROCYCLIC CONDENSED COMPOUNDS USEFUL AS ANTIDIURETIC AGENTS VANTIA LTD (GB) 2010-02-03 EP claimed
EP-1778677-B1 HETEROCYCLIC CONDENSED COMPOUNDS USEFUL AS ANTIDIURETIC AGENTS VANTIA LTD (GB) 2010-02-03 EP disclosed