SCHEMBL7740451

SCHEMBL7740451

CCOCOCC(CC(Cc1cccnc1)C(=O)NO)NC(=O)c1ccc(C)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 1/20 0.43
LMNA P02545 3/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 2/20 0.39
PKM P14618 1/20 0.39
HPGD P15428 3/20 0.38
POLB P06746 2/20 0.38
GLA P06280 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GPR132 Q9UNW8 1/20 0.38
ECE1 P42892 1/20 0.38
NAMPT P43490 3/20 0.38
ALDH1A1 P00352 2/20 0.37
HTT P42858 1/20 0.37
MMP9 P14780 2/20 0.37
MMP2 P08253 1/20 0.37
KDM4E B2RXH2 2/20 0.36
MMP8 P22894 1/20 0.36
CTSL P07711 1/20 0.36
CTSB P07858 1/20 0.36

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
SCHEMBL7740453 1.00 MMP13 (0.43) MMP13LMNAMAPK1KMT2APKM
SCHEMBL7741296 0.93 KMT2A (0.41) MMP13LMNAMAPK1KMT2APKM
SCHEMBL7741294 0.93 KMT2A (0.41) MMP13LMNAMAPK1KMT2APKM
SCHEMBL7741077 0.91 GAA (0.48) LMNAMAPK1KMT2AHPGDPOLB
SCHEMBL7741080 0.91 GAA (0.48) LMNAMAPK1KMT2AHPGDPOLB
SCHEMBL7739872 0.91 LMNA (0.43) LMNAGPR132ECE1KDM4ECTSL
SCHEMBL7739867 0.91 LMNA (0.43) LMNAGPR132ECE1KDM4ECTSL
SCHEMBL7734685 0.89 SMN1; SMN2 (0.41) LMNAMAPK1KMT2ASMN1; SMN2NAMPT
SCHEMBL7734694 0.89 SMN1; SMN2 (0.41) LMNAMAPK1KMT2ASMN1; SMN2NAMPT
SCHEMBL7740333 0.89 CTSL (0.45) MMP9MMP2MMP8CTSLGAA

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