SCHEMBL14281153

SCHEMBL14281153

O=C/C=C/c1cc(O)c(O)c(C=O)c1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ XDH P47989 2/20 0.53
▸ GABBR2 O75899 1/20 0.49
▸ GABBR1 Q9UBS5 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ MMP2 P08253 1/20 0.43
▸ CDK4 P11802 2/20 0.43
▸ CCND1 P24385 2/20 0.43
▸ CCNB2 O95067 1/20 0.43
▸ CDK1 P06493 1/20 0.43
▸ CCNB1 P14635 1/20 0.43
▸ CCNB3 Q8WWL7 1/20 0.43
▸ ERN1 O75460 4/20 0.41
▸ PIM1 P11309 1/20 0.38
▸ ALOX5 P09917 2/20 0.38
▸ TRPA1 O75762 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ MAPK1 P28482 1/20 0.38

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
SCHEMBL14281151 0.90 GABBR2 (0.53) XDHGABBR2GABBR1ALDH1A1KDM4E
SCHEMBL5849926 0.86 XDH (0.63) XDHGABBR2GABBR1ALDH1A1KDM4E
SCHEMBL1527073 0.81 XDH (0.52) XDHALDH1A1KDM4EERN1PIM1
SCHEMBL27319981 0.81 ERN1 (0.45) XDHKDM4EERN1PIM1
SCHEMBL13176649 0.74 XDH (0.68) XDHGABBR2GABBR1ALDH1A1KDM4E
SCHEMBL151754 0.74 XDH (0.68) XDHGABBR2GABBR1ALDH1A1KDM4E
SCHEMBL8848024 0.73 GABBR2 (0.57) XDHGABBR2GABBR1ALDH1A1KDM4E
SCHEMBL8848018 0.73 GABBR2 (0.57) XDHGABBR2GABBR1ALDH1A1KDM4E
SCHEMBL14492368 0.72 XDH (0.70) XDHALDH1A1KDM4EMAPTMAPK1
SCHEMBL7243507 0.72 XDH (0.70) XDHALDH1A1KDM4EMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080058510-A1 ALTERING LIGNIN AND WOOD DENSITY ALELLYX S.A. 2008-03-06 — — US disclosed
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