SCHEMBL2861854

SCHEMBL2861854

O=C(c1ccccc1)c1cccc(C(O)O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.66
ALDH1A1 P00352 4/20 0.66
PTGS1 P23219 3/20 0.66
PTGS2 P35354 3/20 0.66
CXCR1 P25024 2/20 0.66
CXCR2 P25025 2/20 0.66
SMN1; SMN2 Q16637 2/20 0.66
LMNA P02545 2/20 0.66
CYP3A4 P08684 2/20 0.66
RECQL P46063 1/20 0.66
KDM4E B2RXH2 1/20 0.66
HPGD P15428 1/20 0.66
MAPK1 P28482 1/20 0.66
PMP22 Q01453 1/20 0.66
SLC22A6 Q4U2R8 1/20 0.66
HSD17B10 Q99714 1/20 0.66
CXCL8 P10145 1/20 0.66
THPO P40225 1/20 0.66
HIF1A Q16665 1/20 0.66
ATM Q13315 1/20 0.65

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
SCHEMBL15264145 0.86 MAPT (0.64) MAPTALDH1A1PTGS1PTGS2CXCR1
SCHEMBL4669024 0.85 PTGS1 (0.72) MAPTALDH1A1PTGS1PTGS2CXCR1
SCHEMBL31150150 0.85 PTGS1 (0.72) MAPTALDH1A1PTGS1PTGS2CXCR1
SCHEMBL27806198 0.85 LMNA (0.67) MAPTALDH1A1PTGS1PTGS2CXCR1
SCHEMBL13653040 0.85 PTGS1 (0.72) MAPTALDH1A1PTGS1PTGS2CXCR1
SCHEMBL1237712 0.83 ANPEP (0.59) MAPTALDH1A1PTGS1PTGS2CXCR1
SCHEMBL23018871 0.83 ATM (0.64) MAPTALDH1A1PTGS1PTGS2CXCR1
SCHEMBL20696554 0.83 ATM (0.64) MAPTALDH1A1PTGS1PTGS2CXCR1
SCHEMBL9798597 0.82 MAPT (0.64) MAPTALDH1A1PTGS1PTGS2CXCR1
SCHEMBL764365 0.82 MAPT (0.74) MAPTALDH1A1PTGS1PTGS2CXCR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7713449-B2 Polymer electrolytic material, polymer electrolytic part, membrane electrode assembly, and polymer electrolyte fuel cell TORAY INDUSTRIES, INC. (JP) 2010-05-11 US disclosed
US-20060180796-A1 Polymer electrolyte material, polymer electrolyte part, membrane electrode composite and polymer electrolyte type fuel cell TORAY INDUSTRIES, INC. (JP) 2006-08-17 US disclosed
EP-1619735-A1 POLYMER ELECTROLYTE MATERIAL, POLYMER ELECTROLYTE PART, MEMBRANE ELECTRODE COMPOSITE AND POLYMER ELECTROLYTE TYPE FUEL CELL TORAY INDUSTRIES, INC. (JP) 2006-01-25 EP disclosed