SCHEMBL7741235

SCHEMBL7741235

CCOCOCC(CC(Cc1cccc(OC(F)(F)F)c1)C(=O)NO)NC(=O)c1ccc(Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.41
HDAC8 Q9BY41 1/20 0.39
PPARG P37231 9/20 0.39
PPARA Q07869 8/20 0.39
CYP2C9 P11712 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
CYP4X1 Q8N118 1/20 0.39
MAPK14 Q16539 1/20 0.39
TRPV1 Q8NER1 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
GCGR P47871 1/20 0.38
ABCB1 P08183 1/20 0.37
ROCK2 O75116 1/20 0.37
ROCK1 Q13464 1/20 0.37
KLKB1 P03952 1/20 0.37
EGFR P00533 1/20 0.37
CHRM4 P08173 1/20 0.37

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
SCHEMBL7741237 1.00 CNR1 (0.41) CNR1HDAC8PPARGPPARACYP2C9
SCHEMBL7742522 0.90 HDAC1 (0.41) CNR1PPARAHDAC1HTT
SCHEMBL7742518 0.90 HDAC1 (0.41) CNR1PPARAHDAC1HTT
SCHEMBL7740127 0.86 HTT (0.44) PPARGHTT
SCHEMBL7740130 0.86 HTT (0.44) PPARGHTT
SCHEMBL7742477 0.85 CTSL (0.46) PPARGPPARAHDAC1
SCHEMBL7742479 0.85 CTSL (0.46) PPARGPPARAHDAC1
SCHEMBL7739826 0.83 CTSS (0.49) HDAC1HTT
SCHEMBL7739831 0.83 CTSS (0.49) HDAC1HTT
SCHEMBL7741049 0.83 MEN1 (0.46) HDAC8PPARAHDAC1

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