SCHEMBL2903201

SCHEMBL2903201

CCCCCCCCc1cc(C)c(C=O)o1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
ELANE P08246 3/20 0.40
EPHX2 P34913 1/20 0.38
ALOX15 P16050 1/20 0.38
HIF1A Q16665 1/20 0.38
EPAS1 Q99814 1/20 0.38
SIRT2 Q8IXJ6 1/20 0.37
PPARA Q07869 1/20 0.35
THRB P10828 1/20 0.35
STS P08842 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.35
GAA P10253 1/20 0.35
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
SRC P12931 1/20 0.35
GPR84 Q9NQS5 2/20 0.34
CYP19A1 P11511 1/20 0.34

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
SCHEMBL7333565 0.93 MAPT (0.37) MAPTSMN1; SMN2ELANEEPHX2ALOX15
SCHEMBL14543752 0.86 TLR8 (0.33) MAPTSMN1; SMN2ALOX15STSALDH1A1
SCHEMBL20122065 0.77 MAPT (0.45) MAPTSMN1; SMN2ELANEEPHX2ALOX15
SCHEMBL27790133 0.75 MEN1 (0.44) MAPTHIF1AEPAS1THRBALDH1A1
SCHEMBL3923901 0.74 MAPT (0.42) MAPTSMN1; SMN2ELANEALOX15SIRT2
SCHEMBL31331625 0.73 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1GAATSHR
SCHEMBL9303002 0.71 HCAR2 (0.34) MAPTELANEEPHX2ALOX15HIF1A
SCHEMBL9304633 0.71 ELANE (0.36) ELANEGPR84
SCHEMBL25201803 0.70 ALDH1A1 (0.53) MAPTSMN1; SMN2ELANEEPHX2ALOX15
SCHEMBL22230787 0.70 ALDH1A1 (0.53) MAPTSMN1; SMN2ELANEEPHX2ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2197866-B1 HYDROXYMETHYLFURFURAL ETHERS FROM SUGARS AND HIGHER ALCOHOLS FURANIX TECHNOLOGIES BV (NL) 2013-02-27 EP disclosed
US-20100218415-A1 HYDROXYMETHYLFURFURAL ETHERS FROM SUGARS AND HIGHER ALCOHOLS FURANIX TECHNOLOGIES B.V. (NL) 2010-09-02 US disclosed
EP-2197866-A2 HYDROXYMETHYLFURFURAL ETHERS FROM SUGARS AND HIGHER ALCOHOLS Furanix Technologies B.V (NL) 2010-06-23 EP disclosed
WO-2009030507-A2 HYDROXYMETHYLFURFURAL ETHERS FROM SUGARS AND HIGHER ALCOHOLS FURANIX TECHNOLOGIES B.V. (NL) 2009-03-12 WO disclosed