SCHEMBL7742672

SCHEMBL7742672

CNC(=O)[C@H](CCC(=O)O)NC(=O)c1ccc(C)cc1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADAMTS5 Q9UNA0 2/20 0.54
ADAMTS4 O75173 1/20 0.54
CA2 P00918 3/20 0.51
CA1 P00915 2/20 0.51
TDP1 Q9NUW8 1/20 0.49
LMNA P02545 1/20 0.49
HSD17B10 Q99714 1/20 0.49
KMT2A Q03164 2/20 0.49
MMP2 P08253 1/20 0.48
MMP8 P22894 1/20 0.48
MMP12 P39900 1/20 0.48
BMP1 P13497 2/20 0.48
CA12 O43570 1/20 0.47
CA9 Q16790 1/20 0.47
FOLH1 Q04609 2/20 0.47
MEN1 O00255 1/20 0.46
SMN1; SMN2 Q16637 1/20 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
SCHEMBL7740298 1.00 ADAMTS5 (0.54) ADAMTS5ADAMTS4CA2CA1TDP1
SCHEMBL7740302 1.00 ADAMTS5 (0.54) ADAMTS5ADAMTS4CA2CA1TDP1
SCHEMBL7740886 0.89 HDAC1 (0.46) ADAMTS5ADAMTS4TDP1KMT2ABMP1
SCHEMBL7742778 0.89 HDAC1 (0.46) ADAMTS5ADAMTS4TDP1KMT2ABMP1
SCHEMBL7740882 0.89 HDAC1 (0.46) ADAMTS5ADAMTS4TDP1KMT2ABMP1
SCHEMBL8379946 0.87 CA2 (0.66) ADAMTS5ADAMTS4CA2CA1TDP1
SCHEMBL1640055 0.87 CA2 (0.66) ADAMTS5ADAMTS4CA2CA1TDP1
SCHEMBL20756959 0.83 CA2 (0.55) ADAMTS5ADAMTS4CA2CA1CA12
SCHEMBL7734771 0.82 HPGD (0.44) ADAMTS5ADAMTS4TDP1KMT2AMMP2
SCHEMBL7741064 0.82 MMP2 (0.54) ADAMTS5ADAMTS4TDP1KMT2AMMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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