SCHEMBL5361836

SCHEMBL5361836

CCCON=C(COc1cccc(OC(C)=O)c1C)c1cc(-c2ccc(F)cc2)no1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.38
▸ LMNA P02545 2/20 0.38
▸ PPARG P37231 2/20 0.38
▸ PPARA Q07869 2/20 0.38
▸ KMT2A Q03164 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ RAB9A P51151 5/20 0.35
▸ SMN1; SMN2 Q16637 5/20 0.35
▸ TP53 P04637 2/20 0.35
▸ NPC1 O15118 3/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ POLB P06746 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ PTPN1 P18031 2/20 0.34
▸ CASP3 P42574 1/20 0.33
▸ SENP8 Q96LD8 1/20 0.33
▸ SENP7 Q9BQF6 1/20 0.33

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
SCHEMBL5361842 0.86 PPARG (0.40) MAPTLMNAPPARGPPARAKMT2A
SCHEMBL5314039 0.83 MEN1 (0.41) MAPTLMNAPPARGPPARAKMT2A
SCHEMBL5314031 0.83 MEN1 (0.41) MAPTLMNAPPARGPPARAKMT2A
SCHEMBL5311809 0.82 MEN1 (0.40) MAPTLMNAPPARGPPARAKMT2A
SCHEMBL5311812 0.82 MEN1 (0.40) MAPTLMNAPPARGPPARAKMT2A
SCHEMBL14530969 0.81 RAB9A (0.45) MAPTLMNAPPARGPPARAKMT2A
SCHEMBL14530972 0.80 PDE10A (0.43) MAPTLMNAPPARGPPARAKMT2A
SCHEMBL5310846 0.80 PDE10A (0.43) MAPTLMNAPPARGPPARAKMT2A
SCHEMBL5311834 0.80 MAPT (0.47) MAPTPPARGPPARAKMT2AMEN1
SCHEMBL5311831 0.80 MAPT (0.47) MAPTPPARGPPARAKMT2AMEN1

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-2007058504-A1 NOVEL COMPOUNDS AS AGONIST FOR PPAR GAMMA AND PPAR ALPHA, METHOD FOR PREPARATION OF THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES, LTD. (KR) 2007-05-24 — — WO disclosed
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