SCHEMBL7272533

SCHEMBL7272533

CCCC[C@H](NC(=O)[C@H](Cc1cccc2c1CCCC2)CS(=O)(=O)CC)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 4/20 0.42
▸ MMP3 P08254 2/20 0.42
▸ MMP1 P03956 2/20 0.42
▸ MMP9 P14780 1/20 0.42
▸ MMP14 P50281 1/20 0.42
▸ ADAM17 P78536 1/20 0.42
▸ MME P08473 3/20 0.41
▸ ACE P12821 1/20 0.41
▸ CPA1 P15085 1/20 0.41
▸ ACE2 Q9BYF1 1/20 0.41
▸ ECE1 P42892 1/20 0.41
▸ PTGES O14684 1/20 0.38
▸ ALOX5 P09917 1/20 0.38
▸ PPARG P37231 1/20 0.38
▸ PPARA Q07869 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ ITGB1 P05556 1/20 0.36
▸ ITGA4 P13612 1/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ MEN1 O00255 1/20 0.36

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
SCHEMBL7266079 0.83 MME (0.47) MMP2MMP3MMP1MMEACE
SCHEMBL7280278 0.83 MME (0.47) MMP2MMP3MMP1MMEACE
SCHEMBL7267914 0.81 HRH4 (0.53) MMP2MMP3MMP9MMP14MME
SCHEMBL7278135 0.81 HRH4 (0.53) MMP2MMP3MMP9MMP14MME
SCHEMBL7268334 0.77 MMP2 (0.46) MMP2MMP9MMEACECPA1
SCHEMBL7267941 0.76 MMP3 (0.41) MMP2MMP3MMP1MMP9MMP14
SCHEMBL7273905 0.76 REN (0.49) —
SCHEMBL7267538 0.75 MME (0.50) MMP2MMP3MMP1MMEACE
SCHEMBL9083662 0.74 HRH4 (0.50) MMP2MMP3MMP9MMEACE
SCHEMBL8486125 0.71 BCL2L1 (0.44) MMP2MMP3MMP1MMP9MMP14

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
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