SCHEMBL7739498

SCHEMBL7739498

COCOC[C@H](C[C@H](CCCc1ccccc1)C(=O)NO)NC(=O)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 15/20 0.51
MMP9 P14780 9/20 0.51
MMP12 P39900 4/20 0.51
FDFT1 P37268 1/20 0.42
ADAM17 P78536 1/20 0.42
MMP3 P08254 7/20 0.41
MMP1 P03956 3/20 0.41
MMP8 P22894 3/20 0.41
MMP14 P50281 1/20 0.39
MEN1 O00255 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL7739494 1.00 MMP2 (0.51) MMP2MMP9MMP12FDFT1ADAM17
SCHEMBL7741137 0.89 MMP2 (0.54) MMP2MMP9MMP12ADAM17MMP1
SCHEMBL7739319 0.89 MMP2 (0.54) MMP2MMP9MMP12ADAM17MMP1
SCHEMBL7734666 0.89 MMP2 (0.54) MMP2MMP9MMP12ADAM17MMP1
SCHEMBL7734671 0.89 MMP2 (0.54) MMP2MMP9MMP12ADAM17MMP1
SCHEMBL7739309 0.89 MMP2 (0.54) MMP2MMP9MMP12ADAM17MMP1
SCHEMBL7740533 0.89 MMP2 (0.54) MMP2MMP9MMP12ADAM17MMP1
SCHEMBL7739432 0.87 MMP2 (0.56) MMP2MMP9MMP12ADAM17MMP1
SCHEMBL7739424 0.87 MMP2 (0.56) MMP2MMP9MMP12ADAM17MMP1
SCHEMBL7735246 0.86 MMP2 (0.39) MMP2MMP9MMP12MMP3MMP1

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