SCHEMBL7742448

SCHEMBL7742448

COCOC[C@H](C[C@H](C)C(=O)NO)NC(=O)c1ccc(C#CCOc2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 4/20 0.53
MMP9 P14780 4/20 0.53
MMP12 P39900 4/20 0.53
ACACB O00763 1/20 0.38

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
SCHEMBL7742443 1.00 MMP2 (0.53) MMP2MMP9MMP12ACACB
SCHEMBL7739758 0.88 MMP2 (0.40) MMP2MMP9MMP12ACACB
SCHEMBL7742624 0.88 MMP2 (0.40) MMP2MMP9MMP12ACACB
SCHEMBL7739761 0.88 MMP2 (0.40) MMP2MMP9MMP12ACACB
SCHEMBL5998380 0.85 MMP2 (0.73) MMP2MMP9MMP12
SCHEMBL5998377 0.85 MMP2 (0.73) MMP2MMP9MMP12
SCHEMBL7734957 0.85 EGLN1 (0.37) MMP2MMP9MMP12ACACB
SCHEMBL7734967 0.85 EGLN1 (0.37) MMP2MMP9MMP12ACACB
SCHEMBL7734661 0.84 MMP2 (0.47) MMP2MMP9MMP12
SCHEMBL7734657 0.84 MMP2 (0.47) MMP2MMP9MMP12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6420427-B1 PREVENTION AND/OR TREATMENT OF RHEUMATOID DISEASES, ARTHROSTEITIS, UNUSUAL BONE RESORPTION, OSTEOPOROSIS, PERIODONTITIS, INTERSTITIAL NEPHRITIS, ARTERIOSCLEROSIS, PULMONARY EMPHYSEMA, CIRRHOSIS, CORNEA INJURY ONO PHARMACEUTICAL CO., LTD. (JP) 2002-07-16 US claimed
EP-1024134-A1 AMINOBUTANOIC ACID DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 2000-08-02 EP claimed
US-6420427-B1 PREVENTION AND/OR TREATMENT OF RHEUMATOID DISEASES, ARTHROSTEITIS, UNUSUAL BONE RESORPTION, OSTEOPOROSIS, PERIODONTITIS, INTERSTITIAL NEPHRITIS, ARTERIOSCLEROSIS, PULMONARY EMPHYSEMA, CIRRHOSIS, CORNEA INJURY ONO PHARMACEUTICAL CO., LTD. (JP) 2002-07-16 US disclosed
EP-1024134-A1 AMINOBUTANOIC ACID DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 2000-08-02 EP disclosed