SCHEMBL3269643

SCHEMBL3269643

O=Cc1ccccc1OC(=O)c1cc(O)cc(O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 1/20 0.53
PTGDR2 Q9Y5Y4 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
ALDH1A1 P00352 2/20 0.46
HTT P42858 2/20 0.46
HPGD P15428 1/20 0.46
SRC P12931 1/20 0.45
KMT2A Q03164 5/20 0.44
MAPT P10636 3/20 0.44
GAA P10253 2/20 0.44
ESR1 P03372 2/20 0.44
ESR2 Q92731 2/20 0.44
MEN1 O00255 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
JAK2 O60674 1/20 0.44
USP2 O75604 1/20 0.44
ALOX15 P16050 1/20 0.44
HSD17B10 Q99714 1/20 0.44
PTGES O14684 1/20 0.43
ALOX5 P09917 1/20 0.43

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
SCHEMBL3269041 0.85 ESR1 (0.49) SERPINE1PTGDR2SMN1; SMN2ALDH1A1HTT
SCHEMBL6374160 0.82 KMT2A (0.61) PTGDR2SMN1; SMN2ALDH1A1HTTHPGD
SCHEMBL10783800 0.81 SERPINE1 (0.62) SERPINE1SMN1; SMN2ALDH1A1HPGDKMT2A
SCHEMBL3000837 0.81 ESR1 (0.56) SERPINE1SMN1; SMN2KMT2AMAPTGAA
SCHEMBL1682303 0.77 POLB (0.56) PTGDR2SMN1; SMN2ALDH1A1HTTHPGD
SCHEMBL28892176 0.77 PTGDR2 (0.46) SERPINE1PTGDR2SMN1; SMN2ALDH1A1HTT
SCHEMBL14645912 0.77 ESR1 (0.59) PTGDR2SMN1; SMN2ALDH1A1HTTHPGD
SCHEMBL13778754 0.75 KMT2A (0.58) SERPINE1PTGDR2SMN1; SMN2ALDH1A1HTT
SCHEMBL5702232 0.75 HPGD (0.65) PTGDR2SMN1; SMN2ALDH1A1HTTHPGD
SCHEMBL8579998 0.74 ALDH1A1 (0.59) PTGDR2SMN1; SMN2ALDH1A1HTTHPGD

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-20110059881-A1 Sulphur Free Composition And Lubricant Composition And Methods Thereof THE LUBRIZOL CORPORATION (US) 2011-03-10 US disclosed
EP-1587901-B1 SULPHUR FREE COMPOSITION AND LUBRICANT COMPOSITION AND METHODS THEREOF LUBRIZOL CORP (US) 2010-06-16 EP disclosed
US-20060247140-A1 Sulphur free composition and lubricant composition and methods thereof LUBRIZOL CORPORATION, THE 2006-11-02 US disclosed