SCHEMBL7741290

SCHEMBL7741290

CCOc1ccc(-c2ccc(C(=O)N[C@H](COCOC)C[C@H](C)C(=O)NO)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 5/20 0.51
MMP9 P14780 4/20 0.51
MMP12 P39900 4/20 0.51
TAS1R3 Q7RTX0 3/20 0.49
TAS1R1 Q7RTX1 3/20 0.49
NPSR1 Q6W5P4 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
MMP3 P08254 1/20 0.43
PPARG P37231 1/20 0.42
HPGD P15428 1/20 0.42
HRH3 Q9Y5N1 1/20 0.41
PLK1 P53350 1/20 0.41
GAA P10253 1/20 0.41
RAB9A P51151 1/20 0.41
ASAH2 Q9NR71 2/20 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
SCHEMBL7741283 1.00 MMP2 (0.51) MMP2MMP9MMP12TAS1R3TAS1R1
SCHEMBL7739552 0.91 MMP2 (0.48) MMP2MMP9MMP12TAS1R3TAS1R1
SCHEMBL7739549 0.91 MMP2 (0.48) MMP2MMP9MMP12TAS1R3TAS1R1
SCHEMBL7740363 0.88 MMP2 (0.59) MMP2MMP9MMP12TAS1R3TAS1R1
SCHEMBL7740362 0.88 MMP2 (0.59) MMP2MMP9MMP12TAS1R3TAS1R1
SCHEMBL7740017 0.88 MMP2 (0.57) MMP2MMP9MMP12RAB9A
SCHEMBL7740015 0.88 MMP2 (0.57) MMP2MMP9MMP12RAB9A
SCHEMBL7739862 0.87 MMP2 (0.69) MMP2MMP9MMP12MMP3RAB9A
SCHEMBL7739858 0.87 MMP2 (0.69) MMP2MMP9MMP12MMP3RAB9A
SCHEMBL7734696 0.87 MMP2 (0.48) MMP2MMP9MMP12TAS1R3TAS1R1

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