Binifibrate

Binifibrate

SCHEMBL6017635

CC(C)(Oc1ccc(C2CC2(Cl)Cl)cc1)C(=O)O.CC(C)(Oc1ccc(C2CC2(Cl)Cl)cc1)C(=O)O.CC(C)(Oc1ccc(CCNC(=O)c2ccc(Cl)cc2)cc1)C(=O)O.CC(C)(Oc1ccc(Cl)cc1)C(=O)OC(COC(=O)c1cccnc1)COC(=O)c1cccnc1

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PPARAPPARDPPARG

The experimentally established mechanism targets of Binifibrate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA known ✓ Q07869 5/20 0.53
PPARG known ✓ P37231 1/20 0.53
PPARD known ✓ Q03181 1/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
ALDH1A1 P00352 2/20 0.53
FABP2 P12104 1/20 0.53
MAPT P10636 2/20 0.44
LMNA P02545 2/20 0.42
CYP2C9 P11712 1/20 0.42
TSHR P16473 1/20 0.42
BLM P54132 1/20 0.42
KDM4E B2RXH2 3/20 0.42
PKM P14618 1/20 0.42
KMT2A Q03164 3/20 0.41
TBXA2R P21731 1/20 0.41
TBXAS1 P24557 1/20 0.41
ROCK2 O75116 2/20 0.39
MEN1 O00255 2/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 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
Binifibrate SCHEMBL3654211 1.00 PPARA (0.53) PPARASMN1; SMN2ALDH1A1FABP2PPARG
Binifibrate SCHEMBL3959320 0.91 LMNA (0.52) PPARASMN1; SMN2ALDH1A1FABP2PPARG
Bezafibrate SCHEMBL7079797 0.82 PPARA (0.77) PPARASMN1; SMN2ALDH1A1FABP2PPARG
Binifibrate SCHEMBL49116 0.78 KMT2A (0.51) PPARASMN1; SMN2ALDH1A1PPARGMAPT
Binifibrate SCHEMBL29388376 0.78 KMT2A (0.51) PPARASMN1; SMN2ALDH1A1PPARGMAPT
Bezafibrate SCHEMBL5077755 0.72 PPARA (1.00) PPARASMN1; SMN2ALDH1A1FABP2PPARG
Bezafibrate SCHEMBL16299 0.72 PPARA (1.00) PPARASMN1; SMN2ALDH1A1FABP2PPARG
SCHEMBL11759022 0.72 KMT2A (0.67) PPARASMN1; SMN2ALDH1A1FABP2PPARG
Bezafibrate SCHEMBL22364278 0.72 PPARA (0.98) PPARASMN1; SMN2ALDH1A1FABP2PPARG
Bezafibrate SCHEMBL3088387 0.72 PPARA (0.98) PPARASMN1; SMN2ALDH1A1FABP2PPARG

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-1684704-A2 COMPOSITIONS AND METHODS FOR INCREASING HDL AND HDL-2B LEVELS Tawakol, Raif M. (US) 2006-08-02 EP disclosed
WO-2005041878-A2 COMPOSITIONS AND METHODS FOR INCREASING HDL AND HDL-2B LEVELS TAWAKOL RAIF M D (US) 2005-05-12 WO disclosed