SCHEMBL2540541

SCHEMBL2540541

CCOc1ccc(C(=O)O)c(CC)c1OCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
HSD17B10 Q99714 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 1/20 0.47
TSHR P16473 5/20 0.46
LMNA P02545 1/20 0.46
MRGPRX4 Q96LA9 1/20 0.44
GLA P06280 1/20 0.41
KMT2A Q03164 2/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CREBBP Q92793 1/20 0.39
MEN1 O00255 1/20 0.39
HTT P42858 1/20 0.39
PDE4D Q08499 1/20 0.39
CYP3A4 P08684 1/20 0.39
POLB P06746 1/20 0.38
CASP6 P55212 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
SCHEMBL31068664 0.88 HSD17B10 (0.42) KDM4EL3MBTL1HSD17B10ALDH1A1HPGD
SCHEMBL5613052 0.85 MRGPRX4 (0.40) KDM4EL3MBTL1HSD17B10ALDH1A1HPGD
SCHEMBL6896319 0.84 TSHR (0.50) KDM4EL3MBTL1HSD17B10ALDH1A1HPGD
SCHEMBL6515257 0.82 TSHR (0.45) KDM4EL3MBTL1HSD17B10ALDH1A1TSHR
SCHEMBL6704275 0.81 ALDH1A1 (0.40) KDM4EALDH1A1MRGPRX4KMT2AMAPT
SCHEMBL8629610 0.81 LMNA (0.50) KDM4EL3MBTL1HSD17B10ALDH1A1HPGD
SCHEMBL4403623 0.80 FOLH1 (0.51) KDM4EL3MBTL1ALDH1A1HPGDMRGPRX4
SCHEMBL14907060 0.80 HSD17B10 (0.47) KDM4EL3MBTL1HSD17B10ALDH1A1HPGD
SCHEMBL3782773 0.78 MAPT (0.62) KDM4EALDH1A1HPGDTSHRLMNA
SCHEMBL15312290 0.78 HSD17B10 (0.40) KDM4EL3MBTL1HSD17B10ALDH1A1HPGD

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-8043423-B2 Pigment dispersion liquid, ink jet recording ink, ink jet recording method, ink cartridge and ink jet recording apparatus CANON FINETECH INC. (JP) 2011-10-25 US disclosed