SCHEMBL7369317

SCHEMBL7369317

O=C(N[C@@H](Cc1c[nH]cn1)C(=O)NC(CC1CCCCC1)C(O)c1ncc[nH]1)C(Cc1cccc2ccccc12)Cc1cccc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
REN P00797 19/20 0.52
P2RX1 P51575 1/20 0.40

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
SCHEMBL7382620 0.91 REN (0.56) REN
SCHEMBL7277254 0.89 REN (0.46) RENP2RX1
SCHEMBL9740080 0.88 REN (0.48) REN
SCHEMBL9740075 0.88 REN (0.48) REN
SCHEMBL7369515 0.88 REN (0.56) REN
SCHEMBL7293684 0.84 REN (0.50) REN
SCHEMBL7381237 0.84 REN (0.52) REN
SCHEMBL7335944 0.83 REN (0.67) REN
SCHEMBL10421139 0.83 REN (0.52) REN
SCHEMBL7367557 0.83 REN (0.52) REN

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
EP-0231919-A2 N-Heterocyclic alcohol renin inhibitors E.R. Squibb & Sons, Inc. (US) 1987-08-12 EP disclosed