SCHEMBL9502428

SCHEMBL9502428

COc1ccc(C[C@H](N)C(=O)N(C)C(=O)[C@H](CC(C)C)NCP(=O)(O)O)cc1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 13/20 0.41
▸ ANPEP P15144 3/20 0.41
▸ ERAP2 Q6P179 2/20 0.41
▸ MMP3 P08254 2/20 0.41
▸ MMP9 P14780 2/20 0.41
▸ ADAM17 P78536 1/20 0.41
▸ MMP2 P08253 1/20 0.39
▸ SLC6A4 P31645 1/20 0.39

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
SCHEMBL9502367 1.00 MMP1 (0.41) MMP1ANPEPERAP2MMP3MMP9
SCHEMBL9502477 0.89 MMP9 (0.42) MMP1ANPEPERAP2MMP3MMP9
SCHEMBL9502445 0.89 MMP9 (0.42) MMP1ANPEPERAP2MMP3MMP9
SCHEMBL9502292 0.89 MMP1 (0.41) MMP1ANPEPERAP2MMP3MMP9
SCHEMBL9502330 0.89 MMP1 (0.41) MMP1ANPEPERAP2MMP3MMP9
SCHEMBL9502092 0.86 MMP1 (0.40) MMP1ANPEPERAP2MMP3MMP9
SCHEMBL9502182 0.86 MMP1 (0.40) MMP1ANPEPERAP2MMP3MMP9
SCHEMBL7329603 0.83 SLC6A4 (0.50) MMP1MMP3MMP9ADAM17MMP2
SCHEMBL10495976 0.82 MMP1 (0.41) MMP1ANPEPERAP2MMP3MMP9
SCHEMBL9502392 0.82 MMP1 (0.41) MMP1ANPEPERAP2MMP3MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0320118-B1 PEPTIDES WITH COLLAGENASE INHIBITING ACTIVITY BEECHAM GROUP PLC (GB) 1993-06-02 — — EP claimed
US-4935404-A ANTIARTHRITIC AGENTS; RHEUMATIC DISEASES BEECHAM GROUP P.L.C. OF BEECHAM HOUSE (GB) 1990-06-19 — — US claimed
EP-0320118-A2 Peptides with collagenase inhibiting activity BEECHAM GROUP PLC (GB) 1989-06-14 — — EP claimed
EP-0320118-B1 PEPTIDES WITH COLLAGENASE INHIBITING ACTIVITY BEECHAM GROUP PLC (GB) 1993-06-02 — — EP disclosed
US-4935404-A ANTIARTHRITIC AGENTS; RHEUMATIC DISEASES BEECHAM GROUP P.L.C. OF BEECHAM HOUSE (GB) 1990-06-19 — — US disclosed
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