SCHEMBL8909747

SCHEMBL8909747

Nc1ccc(OCCOc2c(Cl)cc(OCC=C(Cl)Cl)cc2Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.41
APP P05067 3/20 0.37
TDP1 Q9NUW8 2/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
TSHR P16473 1/20 0.33
PLAU P00749 1/20 0.33
NFE2L2 Q16236 1/20 0.33
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
KMT2A Q03164 1/20 0.32
REN P00797 2/20 0.32
GAA P10253 1/20 0.32
LTA4H P09960 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
PRSS1 P07477 1/20 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
SCHEMBL8896223 0.96 HTT (0.40) HTTAPPTDP1NPC1RAB9A
SCHEMBL8910006 0.96 HTT (0.40) HTTAPPTDP1NPC1RAB9A
SCHEMBL8910126 0.95 HTT (0.39) HTTAPPTDP1NPC1RAB9A
SCHEMBL8407941 0.89 HTT (0.43) HTTTDP1ALDH1A1
SCHEMBL8657700 0.86 HTT (0.40) HTTNPC1RAB9APLAUALDH1A1
SCHEMBL8408726 0.85 HTT (0.42) HTTRAB9AALDH1A1KMT2A
SCHEMBL8405697 0.85 HTT (0.42) HTTALDH1A1KMT2A
SCHEMBL6550042 0.84 HTT (0.42) HTTTDP1RAB9AALDH1A1MAPT
SCHEMBL8659377 0.83 HTT (0.43) HTTNPC1ALDH1A1MAPTKMT2A
SCHEMBL13528419 0.83 HTT (0.43) HTTTDP1NPC1MAPTKMT2A

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
WO-1997027173-A2 DIHALOPROPENE COMPOUNDS, THEIR USE AS INSECTICIDES/ACARICIDES AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-31 WO disclosed