SCHEMBL7266784

SCHEMBL7266784

CCCC[C@H](NC(=O)[C@@H](COCc1ccccc1)Cc1cccc2ccccc12)C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 4/20 0.46
▸ CTSK P43235 3/20 0.46
▸ HRH4 Q9H3N8 1/20 0.46
▸ MME P08473 2/20 0.44
▸ ECE1 P42892 1/20 0.44
▸ PPARA Q07869 2/20 0.43
▸ ACE P12821 1/20 0.43
▸ CPA1 P15085 1/20 0.43
▸ ACE2 Q9BYF1 1/20 0.43
▸ MMP3 P08254 2/20 0.42
▸ MMP1 P03956 1/20 0.42
▸ MMP9 P14780 1/20 0.42
▸ BIRC2 Q13490 1/20 0.41
▸ PPARG P37231 1/20 0.40
▸ CTSL P07711 1/20 0.40
▸ REN P00797 1/20 0.40
▸ MMP2 P08253 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
SCHEMBL7288315 0.86 CTSK (0.48) CTSSCTSKHRH4MMEACE
SCHEMBL7267189 0.86 CTSK (0.48) CTSSCTSKHRH4MMEACE
SCHEMBL7268092 0.86 HRH4 (0.55) CTSSCTSKHRH4MMEACE
SCHEMBL7267197 0.85 CTSK (0.44) CTSSCTSKHRH4MMEACE
SCHEMBL7280871 0.84 CTSK (0.45) CTSSCTSKHRH4MMEECE1
SCHEMBL7275944 0.83 CTSK (0.46) CTSSCTSKHRH4MMEACE
SCHEMBL7275937 0.83 CTSK (0.46) CTSSCTSKHRH4MMEACE
SCHEMBL7268176 0.83 CTSK (0.46) CTSSCTSKHRH4MMEACE
SCHEMBL7267552 0.82 CTSK (0.45) CTSSCTSKHRH4MMEECE1
SCHEMBL7268515 0.82 CTSK (0.45) CTSSCTSKHRH4MMEACE

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0309766-B1 N-acylamino acid derivatives and their use BANYU PHARMA CO LTD (JP) 1998-04-15 — — EP disclosed
US-5506356-A RENIN INHIBITORS; HYPOTENSIVE AGENTS BANYU PHARMACEUTICAL CO., LTD. (JP) 1996-04-09 — — US disclosed
US-5481036-A RENIN INHIBITORS, HYPOTENSIVE AGENTS BANYU PHARMACEUTICAL CO., LTD. (JP) 1996-01-02 — — US disclosed
US-5319082-A N-acylamino acid derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1994-06-07 — — US disclosed
US-5240924-A Dipeptide hypotensives BANYU PHARMACEUTICAL CO., LTD. (JP) 1993-08-31 — — US disclosed
US-5122523-A Hypotensive agents BANYU PHARMACEUTICAL CO., LTD. (JP) 1992-06-16 — — US disclosed
EP-0309766-A2 N-acylamino acid derivatives and their use BANYU PHARMACEUTICAL CO., LTD. (JP) 1989-04-05 — — EP disclosed
Send feedback