SCHEMBL7270930

SCHEMBL7270930

C=C(C)C(=O)OC1CCCCC1.CC(Oc1ccc(C=CC=Cc2ccc(O)cc2)cc1)OC1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 1/20 0.36
ALDH1A1 P00352 2/20 0.34
ALOX15 P16050 1/20 0.34
MAPK1 P28482 1/20 0.34
MAPK10 P53779 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.32
CA12 O43570 1/20 0.32
AKR1B10 O60218 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
AKR1B1 P15121 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CA14 Q9ULX7 1/20 0.32
HTT P42858 1/20 0.32
CYP19A1 P11511 1/20 0.32
MIF P14174 1/20 0.32
APP P05067 1/20 0.31
RAB9A P51151 2/20 0.31

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
SCHEMBL6550268 0.93 STAT3 (0.39) STAT3ALDH1A1ALOX15MAPK1MAPK10
SCHEMBL7269899 0.92 STAT3 (0.38) STAT3ALDH1A1TRPM8CA12AKR1B10
SCHEMBL5702521 0.89 STAT3 (0.34) STAT3ALDH1A1ALOX15MAPK1MAPK10
SCHEMBL3841532 0.89 STAT3 (0.34) STAT3TRPM8CA12AKR1B10CA1
SCHEMBL3826330 0.89 STAT3 (0.32) STAT3CA12AKR1B10CA1CA2
SCHEMBL7270879 0.89 NFKB1 (0.34) STAT3ALDH1A1ALOX15MAPK1MAPK10
SCHEMBL3843023 0.87 APP (0.41) STAT3ALDH1A1MAPK1TRPM8CA12
SCHEMBL7269876 0.87 STAT3 (0.37) STAT3ALDH1A1ALOX15MAPK1MAPK10
SCHEMBL7264890 0.85 KMT2A (0.44) MAPK1HTTCYP19A1SMN1; SMN2MAPT
4-Vinylphenol SCHEMBL6553030 0.83 PPARA (0.33) STAT3TRPM8RAB9ANPC1MAPT

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
US-6656660-B1 Resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-12-02 US disclosed
EP-1024406-A1 Resist composition WAKO PURE CHEMICAL INDUSTRIES LTD (JP) 2000-08-02 EP disclosed