SCHEMBL7267936

SCHEMBL7267936

CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)CS(=O)(=O)CC)C(=O)OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 4/20 0.59
▸ ECE1 P42892 4/20 0.59
▸ CTSL P07711 1/20 0.51
▸ CTSS P25774 1/20 0.51
▸ ANPEP P15144 1/20 0.49
▸ BIRC2 Q13490 1/20 0.48
▸ HDAC3 O15379 2/20 0.47
▸ HDAC4 P56524 2/20 0.47
▸ HDAC1 Q13547 2/20 0.47
▸ HDAC2 Q92769 2/20 0.47
▸ HDAC8 Q9BY41 2/20 0.47
▸ MMP2 P08253 9/20 0.46
▸ MMP1 P03956 4/20 0.46
▸ MMP3 P08254 4/20 0.46

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
SCHEMBL7267929 1.00 MME (0.59) MMEECE1CTSLCTSSANPEP
SCHEMBL7266769 0.84 MME (0.56) MMEECE1CTSLCTSSANPEP
SCHEMBL7266761 0.84 MME (0.56) MMEECE1CTSLCTSSANPEP
SCHEMBL7266764 0.80 MME (0.51) MMEECE1CTSLCTSSANPEP
SCHEMBL7267538 0.79 MME (0.50) MMEECE1HDAC3HDAC4HDAC1
SCHEMBL7266278 0.78 HRH4 (0.48) MMEECE1ANPEPHDAC1HDAC2
SCHEMBL6443866 0.77 MME (0.55) MMEECE1MMP2MMP1MMP3
SCHEMBL6443858 0.77 MME (0.55) MMEECE1MMP2MMP1MMP3
SCHEMBL7266079 0.76 MME (0.47) MMEECE1HDAC3HDAC4HDAC1
SCHEMBL7280278 0.76 MME (0.47) MMEECE1HDAC3HDAC4HDAC1

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 6 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
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