SCHEMBL10521848

SCHEMBL10521848

COC(=O)[C@H](Cc1cnc[nH]1)NC(=O)C(=Cc1ccccc1)CC(=O)NCc1cccc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NLN Q9BYT8 3/20 0.48
▸ ALOX5 P09917 1/20 0.43
▸ REN P00797 4/20 0.43
▸ PDCD1 Q15116 1/20 0.42
▸ CD274 Q9NZQ7 1/20 0.42
▸ FNTA P49354 3/20 0.41
▸ FNTB P49356 2/20 0.41
▸ PGGT1B P53609 1/20 0.41

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
SCHEMBL10521853 0.84 SMN1; SMN2 (0.36) —
SCHEMBL10522368 0.72 REN (0.54) RENFNTAPGGT1B
SCHEMBL10523789 0.72 HRH4 (0.36) —
SCHEMBL10519909 0.71 KMT2A (0.52) —
SCHEMBL10520328 0.71 REN (0.54) NLNRENFNTAFNTBPGGT1B
SCHEMBL11158707 0.71 ITGB2 (0.58) ALOX5PDCD1CD274FNTAFNTB
SCHEMBL14046801 0.71 L3MBTL1 (0.57) ALOX5
SCHEMBL10522976 0.70 ANPEP (0.40) REN
SCHEMBL10519260 0.69 GAA (0.38) FNTAFNTB
SCHEMBL7598348 0.68 ITGB2 (0.55) ALOX5PDCD1CD274

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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