SCHEMBL10422014

SCHEMBL10422014

COC(=O)[C@H](Cc1cnc[nH]1)NC(=O)C(CCOc1ccc(F)cc1)Cc1cccc2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 6/20 0.53
▸ SCN9A Q15858 6/20 0.45
▸ NLN Q9BYT8 2/20 0.42
▸ FNTA P49354 1/20 0.42
▸ PGGT1B P53609 1/20 0.42
▸ PDCD1 Q15116 1/20 0.42
▸ CD274 Q9NZQ7 1/20 0.42

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
SCHEMBL10422431 0.93 REN (0.51) RENSCN9AFNTAPGGT1B
SCHEMBL10422012 0.86 ERAP2 (0.40) RENSCN9A
SCHEMBL10520328 0.82 REN (0.54) RENNLNFNTAPGGT1B
SCHEMBL10422428 0.78 HRH4 (0.47) —
SCHEMBL7380911 0.78 ITGB2 (0.51) RENNLNPDCD1CD274
SCHEMBL10522368 0.77 REN (0.54) RENFNTAPGGT1B
SCHEMBL10421546 0.76 HRH4 (0.39) RENSCN9A
SCHEMBL7381945 0.76 REN (0.71) RENNLNFNTAPGGT1B
SCHEMBL7386111 0.74 REN (0.48) RENPDCD1CD274
SCHEMBL10420797 0.73 CTNNB1 (0.44) —

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
US-4904660-A HYPOTENSIVE AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1990-02-27 — — US disclosed
EP-0281316-A2 Renin inhibitors YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1988-09-07 — — EP disclosed
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