SCHEMBL28635527

SCHEMBL28635527

CC=COCCOc1ccc(C(=O)c2ccccc2)c(O)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.58
HPGD P15428 4/20 0.58
MAPK1 P28482 2/20 0.58
ALDH1A1 P00352 2/20 0.58
CYP1A2 P05177 2/20 0.58
PGR P06401 2/20 0.58
SLC6A2 P23975 2/20 0.58
CYP2C19 P33261 2/20 0.58
CYP2D6 P10635 1/20 0.58
PDE4A P27815 1/20 0.58
HRH1 P35367 1/20 0.58
HTT P42858 1/20 0.58
SLC6A3 Q01959 1/20 0.58
PDE4D Q08499 1/20 0.58
GAA P10253 2/20 0.50
MEN1 O00255 1/20 0.50
USP2 O75604 1/20 0.50
KMT2A Q03164 1/20 0.50
KEAP1 Q14145 1/20 0.50
NFE2L2 Q16236 1/20 0.50

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
SCHEMBL12743862 0.87 LMNA (0.69) LMNAHPGDMAPK1ALDH1A1CYP1A2
SCHEMBL8760151 0.85 LMNA (0.57) LMNAHPGDMAPK1ALDH1A1CYP1A2
SCHEMBL5028940 0.84 LMNA (0.66) LMNAHPGDMAPK1ALDH1A1CYP1A2
Ethylene SCHEMBL27932814 0.84 LMNA (0.56) LMNAHPGDMAPK1ALDH1A1CYP1A2
SCHEMBL28742000 0.83 HPGD (0.58) LMNAHPGDMAPK1ALDH1A1CYP1A2
SCHEMBL10476884 0.83 LMNA (0.69) LMNAHPGDMAPK1ALDH1A1CYP1A2
SCHEMBL7157287 0.83 HPGD (0.63) LMNAHPGDMAPK1ALDH1A1CYP1A2
SCHEMBL545524 0.83 HPGD (0.68) LMNAHPGDMAPK1ALDH1A1CYP1A2
SCHEMBL561993 0.82 HPGD (0.68) LMNAHPGDMAPK1ALDH1A1CYP1A2
SCHEMBL2482330 0.82 HPGD (0.68) LMNAHPGDMAPK1ALDH1A1CYP1A2

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
CN-113454173-A Coating composition 荷兰诺沃赫姆技术涂料私人有限公司 2021-09-28 CN disclosed