SCHEMBL9503807

SCHEMBL9503807

CCOC1OC(=O)c2ccc(OC)c(OC)c21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.50
ALDH1A1 P00352 5/20 0.50
MAPT P10636 1/20 0.50
TDP1 Q9NUW8 2/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
HPGD P15428 2/20 0.39
ACHE P22303 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HSD17B10 Q99714 1/20 0.37
PTPRF P10586 1/20 0.36
LMNA P02545 2/20 0.36
POLB P06746 1/20 0.36
SIRT1 Q96EB6 1/20 0.35
THRB P10828 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL11474768 0.85 KDM4E (0.55) KDM4EALDH1A1MAPTTDP1TP53
SCHEMBL10652417 0.83 ALDH1A1 (0.40) KDM4EALDH1A1MAPTTDP1HPGD
SCHEMBL3782017 0.76 PTPRF (0.46) KDM4EALDH1A1MAPTTDP1TP53
SCHEMBL3788674 0.72 SIRT1 (0.47) KDM4EALDH1A1TDP1TP53SMN1; SMN2
SCHEMBL8496004 0.70 CDK1 (0.54) KDM4EALDH1A1MAPTTDP1TP53
SCHEMBL27596875 0.69 MAPT (0.41) KDM4EALDH1A1MAPTTDP1TP53
SCHEMBL30408659 0.67 POLB (0.45) KDM4EALDH1A1MAPTTP53SMN1; SMN2
SCHEMBL13302911 0.67 POLB (0.45) KDM4EALDH1A1MAPTTP53SMN1; SMN2
SCHEMBL26124118 0.67 KDM4E (0.34) KDM4EALDH1A1MAPTTDP1TP53
SCHEMBL675985 0.66 KDM4E (0.62) KDM4EALDH1A1MAPTTDP1HPGD

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
EP-0377406-B1 PRESSURE-SENSITIVE OR HEAT-SENSITIVE RECORDING MATERIAL CIBA-GEIGY AG (CH) 1993-06-09 EP disclosed
US-5013707-A Pressure- or heat-sensitive recording material CIBA-GEIGY CORPORATION (US) 1991-05-07 US disclosed
EP-0377406-A1 Pressure-sensitive or heat-sensitive recording material CIBA-GEIGY AG (CH) 1990-07-11 EP disclosed