SCHEMBL5270761

SCHEMBL5270761

CC(C)Oc1ccc(-c2c(Oc3ccc(OC(F)(F)F)cc3)ccc3[nH]c(C(=O)O)c(NC(=O)C(C)(C)C)c23)cc1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 2/20 0.33
PPARA Q07869 1/20 0.33
FAAH O00519 1/20 0.33
EPHX2 P34913 1/20 0.33
ACACB O00763 1/20 0.33
ACACA Q13085 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
SCN8A Q9UQD0 4/20 0.32
SCN10A Q9Y5Y9 4/20 0.32
MAPT P10636 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
SERPINE1 P05121 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
CYP2C9 P11712 1/20 0.32
IDO1 P14902 1/20 0.32
TRPV1 Q8NER1 1/20 0.31

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
SCHEMBL5339470 0.92 GPR35 (0.37) PPARDACACBACACASCN8ASCN10A
SCHEMBL5342565 0.82 MAPT (0.45) ACACBACACAMAPTKDM4EALDH1A1
SCHEMBL5271483 0.81 RORC (0.36) ACACBACACAEGLN1MAPTKDM4E
SCHEMBL5269571 0.77 PTGER4 (0.39) PPARDACACBSCN8ASCN10ACYP2C9
SCHEMBL5573980 0.76 MAPT (0.40) PPARDPPARAMAPTKDM4EALDH1A1
SCHEMBL5269374 0.76 FFAR4 (0.36)
SCHEMBL5273163 0.75 PRKAB2 (0.36) PPARDPPARAEGLN1
SCHEMBL5274888 0.75 KDM4E (0.49) MAPTKDM4EALDH1A1HPGD
SCHEMBL5268671 0.74 KDM4E (0.52) MAPTKDM4EALDH1A1HPGD
SCHEMBL5273364 0.74 KDM4E (0.44) ACACBACACAMAPTKDM4EALDH1A1

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
EP-1844013-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-10-17 EP disclosed
WO-2006077364-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2006-07-27 WO disclosed