SCHEMBL9016260

SCHEMBL9016260

COc1cc(/C=C/c2ccc(O)c(OC)c2)oc(=O)c1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.81
HPGD P15428 4/20 0.68
MAPT P10636 4/20 0.68
ALDH1A1 P00352 3/20 0.68
SMN1; SMN2 Q16637 3/20 0.68
TP53 P04637 2/20 0.68
CASP7 P55210 2/20 0.68
HSD17B10 Q99714 2/20 0.68
CASP1 P29466 1/20 0.68
ALOX5 P09917 2/20 0.65
CYP3A4 P08684 3/20 0.64
NFE2L2 Q16236 2/20 0.62
APP P05067 4/20 0.59
TTR P02766 1/20 0.56
PTGS2 P35354 1/20 0.55
PRKCE Q02156 1/20 0.55
PRKCQ Q04759 1/20 0.55
PRKCD Q05655 1/20 0.55
CAMK2A Q9UQM7 1/20 0.55
BACE1 P56817 1/20 0.54

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
SCHEMBL9016262 1.00 HIF1A (0.81) HIF1AHPGDMAPTALDH1A1SMN1; SMN2
SCHEMBL29583263 1.00 HIF1A (0.81) HIF1AHPGDMAPTALDH1A1SMN1; SMN2
SCHEMBL29929793 0.89 HIF1A (1.00) HIF1AHPGDMAPTALDH1A1SMN1; SMN2
SCHEMBL30200254 0.89 HIF1A (1.00) HIF1AHPGDMAPTALDH1A1SMN1; SMN2
SCHEMBL19665470 0.89 HIF1A (0.80) HIF1AHPGDMAPTALDH1A1SMN1; SMN2
SCHEMBL19665468 0.89 HIF1A (0.80) HIF1AHPGDMAPTALDH1A1SMN1; SMN2
SCHEMBL23242770 0.88 ALDH1A1 (0.69) HIF1AHPGDMAPTALDH1A1SMN1; SMN2
SCHEMBL23242768 0.88 ALDH1A1 (0.69) HIF1AHPGDMAPTALDH1A1SMN1; SMN2
SCHEMBL29584432 0.87 HIF1A (0.78) HIF1AHPGDMAPTALDH1A1SMN1; SMN2
SCHEMBL9016241 0.87 HIF1A (0.78) HIF1AHPGDMAPTALDH1A1SMN1; SMN2

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-5585386-A MIXTURES FOR APPLICATION TO SKIN OR SCALP L'OREAL (FR) 1996-12-17 US disclosed