SCHEMBL5312940

SCHEMBL5312940

CCCO/N=C(\COc1ccc(Br)c(C(=O)O)c1)c1cc(-c2ccc(F)cc2)no1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 4/20 0.40
▸ PPARG P37231 2/20 0.39
▸ PPARA Q07869 2/20 0.39
▸ MAPT P10636 4/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36
▸ GSTP1 P09211 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ PDE10A Q9Y233 1/20 0.36
▸ CXCR1 P25024 1/20 0.35
▸ PTPN11 Q06124 2/20 0.35
▸ HAVCR2 Q8TDQ0 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RARA P10276 1/20 0.35
▸ RARB P10826 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
SCHEMBL5312944 1.00 PTPN1 (0.40) PTPN1PPARGPPARAMAPTLMNA
SCHEMBL5331961 0.92 MAPT (0.39) PTPN1PPARGPPARAMAPTLMNA
SCHEMBL5331968 0.92 MAPT (0.39) PTPN1PPARGPPARAMAPTLMNA
SCHEMBL5316013 0.90 PTPN11 (0.42) PTPN1PPARGPPARAMAPTMEN1
SCHEMBL5316012 0.90 PTPN11 (0.42) PTPN1PPARGPPARAMAPTMEN1
SCHEMBL5313700 0.89 PTPN1 (0.38) PTPN1PPARGPPARAMAPTLMNA
SCHEMBL5313698 0.89 PTPN1 (0.38) PTPN1PPARGPPARAMAPTLMNA
SCHEMBL5310291 0.89 PTPN1 (0.37) PTPN1PPARGPPARAMAPTLMNA
SCHEMBL5310297 0.89 PTPN1 (0.37) PTPN1PPARGPPARAMAPTLMNA
SCHEMBL5313621 0.88 MAPT (0.38) PTPN1PPARGPPARAMAPTLMNA

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
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
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
Send feedback