SCHEMBL8224319

SCHEMBL8224319

CC=COc1c(OCC)ccc(Cl)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
HTT P42858 2/20 0.38
MAPK1 P28482 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.35
TSHR P16473 2/20 0.35
HPGD P15428 1/20 0.35
RORC P51449 1/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34
ATM Q13315 1/20 0.34
IKBKB O14920 3/20 0.33
LARS1 Q9P2J5 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
PKM P14618 1/20 0.33
CYP2C19 P33261 1/20 0.33
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
HTR2C P28335 2/20 0.31
HTR2B P41595 2/20 0.31

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
SCHEMBL8219624 0.88 CSNK2A1 (0.41) ALDH1A1HTTL3MBTL1HPGDMAPT
SCHEMBL8227228 0.85 THRB (0.36) ALDH1A1TSHRHPGDMAPTRAB9A
SCHEMBL9636247 0.81 ALDH1A1 (0.35) ALDH1A1MAPK1L3MBTL1TSHRHPGD
SCHEMBL8224316 0.74 HTR2C (0.48) ALDH1A1HTTMAPK1L3MBTL1TSHR
SCHEMBL9635144 0.74 NQO1 (0.33) ALDH1A1TSHRMAPT
SCHEMBL12300309 0.73 L3MBTL1 (0.42) ALDH1A1HTTMAPK1L3MBTL1TSHR
SCHEMBL8227803 0.69 GLA (0.36) ALDH1A1L3MBTL1HPGDMAPTATM
SCHEMBL21192744 0.68 ERN1 (0.43) ALDH1A1HTTMAPK1L3MBTL1TSHR
SCHEMBL8223061 0.68 L3MBTL1 (0.44) ALDH1A1MAPK1L3MBTL1TSHRHPGD
SCHEMBL15722967 0.66 FGFR2 (0.34) ALDH1A1MAPK1L3MBTL1MAPTCYP1A2

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-6140274-A Dihalopropene compounds, their use as insecticides/acaricides and intermediates for their production SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-10-31 US disclosed