SCHEMBL3575233

SCHEMBL3575233

CNc1ncc(Cl)cc1C(=O)N(CCc1cccc(C(F)(F)F)c1)Cc1ccc(OC(C)(C)C)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 2/20 0.42
LPAR1 Q92633 2/20 0.38
LPAR5 Q9H1C0 2/20 0.38
CNR1 P21554 1/20 0.37
FFAR1 O14842 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 1/20 0.36
VNN1 O95497 1/20 0.36
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36
PPARA Q07869 1/20 0.36
LMNA P02545 2/20 0.35
HPGD P15428 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NAMPT P43490 1/20 0.35

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
SCHEMBL3583406 0.91 CNR1 (0.41) SLC2A1LPAR1LPAR5CNR1MEN1
SCHEMBL3570653 0.90 CNR1 (0.39) SLC2A1CNR1LMNAHPGDMEN1
SCHEMBL3570789 0.89 CNR1 (0.39) SLC2A1CNR1LMNAHPGDMAPT
SCHEMBL3581186 0.89 CNR1 (0.39) SLC2A1CNR1FFAR4LMNAHPGD
SCHEMBL3582301 0.88 NAMPT (0.40) SLC2A1CNR1LMNAHPGDMEN1
SCHEMBL3583456 0.88 CNR1 (0.38) SLC2A1CNR1LMNAHPGDMEN1
SCHEMBL3576589 0.87 CHRNA7 (0.40) SLC2A1LPAR1LPAR5ALDH1A1PPARG
SCHEMBL3577424 0.87 NLRP3 (0.39) SLC2A1LPAR1LPAR5PPARGPPARD
SCHEMBL1397656 0.86 CETP (0.39) SLC2A1CNR1LMNAHPGDMEN1
SCHEMBL3579168 0.86 SLC2A1 (0.41) SLC2A1LPAR1LPAR5CNR1PPARG

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-7678818-B2 Anthranilamide and 2-amino-heteroarene-carboxamide compounds HOFFMANN-LA ROCHE INC. (US) 2010-03-16 US claimed
EP-1984340-B1 ANTHRANILAMIDE/2-AMINO-HETEROARENE CARBOXAMIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2012-06-27 EP disclosed
CN-101379036-B Anthranilamide/2-amino-heteroarene carboxamide derivatives HOFFMANN LA ROCHE 2011-06-01 CN disclosed
CN-101379036-A Anthranilamide/2-amino-heteroarene carboxamide derivatives HOFFMANN LA ROCHE (CH) 2009-03-04 CN disclosed