SCHEMBL28635529

SCHEMBL28635529

CC=COC(C)Oc1ccc(C(=O)c2ccccc2)c(O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.60
HPGD P15428 4/20 0.60
CYP1A2 P05177 2/20 0.60
PGR P06401 2/20 0.60
SLC6A2 P23975 2/20 0.60
CYP2C19 P33261 2/20 0.60
MAPK1 P28482 2/20 0.60
ALDH1A1 P00352 2/20 0.60
HTT P42858 2/20 0.60
CYP2D6 P10635 1/20 0.60
PDE4A P27815 1/20 0.60
HRH1 P35367 1/20 0.60
SLC6A3 Q01959 1/20 0.60
PDE4D Q08499 1/20 0.60
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
USP2 O75604 1/20 0.52
GAA P10253 1/20 0.52
KEAP1 Q14145 1/20 0.52
NFE2L2 Q16236 1/20 0.52

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
SCHEMBL12800314 0.88 LMNA (0.72) LMNAHPGDCYP1A2PGRSLC6A2
SCHEMBL28064519 0.84 LMNA (0.67) LMNAHPGDCYP1A2PGRSLC6A2
SCHEMBL4602398 0.82 HPGD (0.72) LMNAHPGDCYP1A2PGRSLC6A2
SCHEMBL2130325 0.82 HPGD (0.63) LMNAHPGDCYP1A2PGRSLC6A2
SCHEMBL15548086 0.81 LMNA (0.67) LMNAHPGDCYP1A2PGRSLC6A2
SCHEMBL4150542 0.81 LMNA (0.70) LMNAHPGDCYP1A2PGRSLC6A2
SCHEMBL210795 0.80 LMNA (0.58) LMNAHPGDCYP1A2PGRSLC6A2
SCHEMBL10557263 0.79 HPGD (0.59) LMNAHPGDCYP1A2PGRSLC6A2
SCHEMBL27898324 0.79 HPGD (0.59) LMNAHPGDCYP1A2PGRSLC6A2
SCHEMBL28964234 0.79 HPGD (0.59) LMNAHPGDCYP1A2PGRSLC6A2

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