SCHEMBL6073433

SCHEMBL6073433

COc1ccccc1OC(=O)N(CC(=O)O)Cc1ccc(OCCN(C)c2ccccn2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.50
PPARA Q07869 7/20 0.50
KMT2A Q03164 4/20 0.48
TSHR P16473 3/20 0.47
MEN1 O00255 3/20 0.47
BLM P54132 2/20 0.47
MAPT P10636 2/20 0.47
LMNA P02545 2/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2D6 P10635 2/20 0.47
CYP2C19 P33261 2/20 0.47
SLC6A3 Q01959 2/20 0.47
GMNN O75496 1/20 0.47
EGFR P00533 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
CYP2C9 P11712 1/20 0.47
ADRB3 P13945 1/20 0.47
ADRA2B P18089 1/20 0.47
NFKB1 P19838 1/20 0.47
TACR2 P21452 1/20 0.47

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
SCHEMBL5422785 0.92 PPARG (0.59) PPARGPPARAKMT2ATSHRMEN1
SCHEMBL6073017 0.90 PPARG (0.54) PPARGPPARAKMT2ATSHRMEN1
SCHEMBL6073101 0.88 PPARG (0.53) PPARGPPARAKMT2ATSHRMEN1
SCHEMBL6073021 0.87 PPARG (0.54) PPARGPPARAKMT2ATSHRMEN1
SCHEMBL6073107 0.84 KMT2A (0.50) PPARGPPARAKMT2ATSHRMEN1
SCHEMBL6073000 0.84 PPARG (0.49) PPARGPPARAKMT2ATSHRMEN1
SCHEMBL6073003 0.84 PPARG (0.50) PPARGPPARAKMT2ATSHRMEN1
SCHEMBL6073180 0.84 KMT2A (0.56) PPARGPPARAKMT2ATSHRMEN1
SCHEMBL6513163 0.82 PPARA (0.58) PPARGPPARATSHRBLMMAPT
SCHEMBL6073197 0.81 KMT2A (0.54) PPARGPPARAKMT2ATSHRMEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006117743-A1 SUBSTITUTED AROMATIC COMPOUNDS AS ANTIDIABETIC AGENTS RANBAXY LABORATORIES LIMITED (IN) 2006-11-09 WO disclosed