SCHEMBL7739653

SCHEMBL7739653

Cc1ccc(C(=O)NC(CCC(=O)OCc2ccccc2)C(=O)OC(C)(C)C)cc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.47
GAA P10253 1/20 0.47
LMNA P02545 1/20 0.46
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.45
KMT2A Q03164 1/20 0.45
ACE P12821 1/20 0.43
CCKBR P32239 2/20 0.43
MAPT P10636 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43

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
SCHEMBL7739654 1.00 POLB (0.47) POLBGAALMNAMEN1ALDH1A1
SCHEMBL18572094 0.84 ALDH1A1 (0.60) POLBGAAMEN1ALDH1A1HPGD
SCHEMBL2011835 0.84 PPARA (0.55) MEN1ALDH1A1HPGDKMT2AACE
SCHEMBL13007476 0.84 PPARA (0.55) MEN1ALDH1A1HPGDKMT2AACE
SCHEMBL13598111 0.84 ADAMTS5 (0.50) LMNAHPGDTDP1CA1CA2
SCHEMBL7742623 0.84 ADAMTS5 (0.50) LMNAHPGDTDP1CA1CA2
SCHEMBL7742625 0.84 ADAMTS5 (0.50) LMNAHPGDTDP1CA1CA2
SCHEMBL1376104 0.83 MEN1 (0.48) POLBGAAMEN1ALDH1A1HPGD
SCHEMBL22612061 0.83 MEN1 (0.48) POLBGAAMEN1ALDH1A1HPGD
SCHEMBL20630934 0.83 MEN1 (0.48) POLBGAAMEN1ALDH1A1HPGD

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 2 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 disclosed
EP-1024134-A1 AMINOBUTANOIC ACID DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 2000-08-02 EP disclosed