SCHEMBL10520328

SCHEMBL10520328

COC(=O)[C@H](Cc1cnc[nH]1)NC(=O)C(CCCCc1ccccc1)Cc1cccc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 8/20 0.54
▸ ERAP2 Q6P179 1/20 0.47
▸ ERAP1 Q9NZ08 1/20 0.47
▸ LNPEP Q9UIQ6 1/20 0.47
▸ FNTA P49354 2/20 0.45
▸ MME P08473 1/20 0.45
▸ ECE1 P42892 1/20 0.45
▸ PGGT1B P53609 1/20 0.45
▸ FNTB P49356 1/20 0.45
▸ NLN Q9BYT8 2/20 0.44

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
SCHEMBL10522368 0.86 REN (0.54) RENFNTAPGGT1B
SCHEMBL10520319 0.84 HRH4 (0.44) RENERAP2ERAP1
SCHEMBL10422014 0.82 REN (0.53) RENFNTAPGGT1BNLN
SCHEMBL9875941 0.79 MME (0.59) RENMMEECE1
SCHEMBL10872035 0.78 REN (0.55) RENFNTAMMEECE1PGGT1B
SCHEMBL7381945 0.78 REN (0.71) RENFNTAPGGT1BFNTBNLN
SCHEMBL29486802 0.76 REN (0.64) REN
SCHEMBL10825069 0.76 REN (0.64) REN
SCHEMBL25054175 0.76 REN (0.56) RENERAP2ERAP1LNPEP
SCHEMBL7380911 0.76 ITGB2 (0.51) RENMMEECE1NLN

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-4863904-A Dipeptides as renin inhibitors KISSEI PHARMACEUTICAL CO., LTD. (JP) 1989-09-05 — — US disclosed
EP-0181110-A2 Histidine derivatives as renin inhibitors Kissei Pharmaceutical Co. Ltd. (JP) 1986-05-14 — — EP disclosed
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