SCHEMBL7740944

SCHEMBL7740944

CCOCOCC(CC(Cc1ccccc1)C(=O)NO)NC(=O)c1cccs1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.45
HPGD P15428 1/20 0.44
MAPT P10636 1/20 0.41
HSPA1A P0DMV8 1/20 0.41
HSPA5 P11021 1/20 0.41
HSPA9 P38646 1/20 0.41
HSPA2 P54652 1/20 0.41
MMP2 P08253 1/20 0.41
MMP3 P08254 1/20 0.41
MMP7 P09237 1/20 0.41
MMP8 P22894 1/20 0.40
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
USP2 O75604 1/20 0.39
MMP1 P03956 1/20 0.39
FCER2 P06734 1/20 0.39
RAB9A P51151 2/20 0.38

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
SCHEMBL7740948 1.00 CTSL (0.45) CTSLHPGDMAPTHSPA1AHSPA5
SCHEMBL7740119 0.89 MAPT (0.40) HPGDMAPTMMP8KDM4EALDH1A1
SCHEMBL7740122 0.89 MAPT (0.40) HPGDMAPTMMP8KDM4EALDH1A1
SCHEMBL7740343 0.87 PIN1 (0.49) CTSLMAPTMMP2MMP8KDM4E
SCHEMBL7740348 0.87 PIN1 (0.49) CTSLMAPTMMP2MMP8KDM4E
SCHEMBL7739307 0.85 PIN1 (0.43) CTSLMAPTMMP2MMP8KDM4E
SCHEMBL7739314 0.85 PIN1 (0.43) CTSLMAPTMMP2MMP8KDM4E
SCHEMBL7734762 0.85 RAB9A (0.49) CTSLMAPTMMP2MMP8KDM4E
SCHEMBL7734756 0.85 RAB9A (0.49) CTSLMAPTMMP2MMP8KDM4E
SCHEMBL7739406 0.85 ROCK2 (0.45) CTSLMAPTMMP2MMP8HDAC1

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