SCHEMBL7977787

SCHEMBL7977787

CCc1cc(OCC=C(Cl)Cl)cc(Cl)c1OCCCCNc1ccc(Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
KDM4E B2RXH2 3/20 0.35
P4HB P07237 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
PNLIP P16233 1/20 0.34
CYP1A2 P05177 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CYP2D6 P10635 2/20 0.32
CYP2C19 P33261 2/20 0.32
CYP3A4 P08684 1/20 0.32
POLB P06746 1/20 0.32
RHOC P08134 1/20 0.32
RHOA P61586 1/20 0.32
ALDH1A1 P00352 3/20 0.31
TDP1 Q9NUW8 1/20 0.31
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
MAPT P10636 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
SCHEMBL7965828 0.97 HTT (0.40) HTTL3MBTL1KDM4EP4HBNPSR1
SCHEMBL7979221 0.95 HTT (0.42) HTTL3MBTL1KDM4EP4HBNPSR1
SCHEMBL7965793 0.91 HTT (0.39) HTTL3MBTL1KDM4EP4HBNPSR1
SCHEMBL7976320 0.88 HTT (0.40) HTTL3MBTL1CYP1A2MEN1KMT2A
SCHEMBL7965701 0.86 HTT (0.37) HTTPNLIPCYP1A2MEN1KMT2A
SCHEMBL7977788 0.85 NPC1 (0.43) L3MBTL1NPSR1KMT2ARHOCRHOA
SCHEMBL7965926 0.84 HTT (0.39) HTTL3MBTL1KDM4ECYP1A2MEN1
SCHEMBL7976362 0.84 HTT (0.41) HTTKDM4EMEN1KMT2ACYP3A4
SCHEMBL7975920 0.84 HTT (0.40) HTTL3MBTL1NPSR1MEN1KMT2A
SCHEMBL7979272 0.83 HTT (0.38) HTTMEN1KMT2ARHOCRHOA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6214835-B1 CONTROLLING INSECTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-04-10 US disclosed
WO-1996033160-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDES CONTAINING THEM AS ACTIVE INGREDIENTS, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-10-24 WO disclosed