SCHEMBL7979221

SCHEMBL7979221

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

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 2/20 0.34
P4HB P07237 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
PNLIP P16233 1/20 0.34
RHOC P08134 1/20 0.33
RHOA P61586 1/20 0.33
ALDH1A1 P00352 3/20 0.33
MAPT P10636 2/20 0.33
GAA P10253 2/20 0.33
CNR1 P21554 1/20 0.32
F2 P00734 1/20 0.31
PPARG P37231 1/20 0.31
S1PR3 Q99500 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
SCHEMBL7977787 0.95 HTT (0.40) HTTL3MBTL1KDM4EP4HBNPSR1
SCHEMBL7965793 0.94 HTT (0.39) HTTL3MBTL1KDM4EP4HBNPSR1
SCHEMBL7965828 0.92 HTT (0.40) HTTL3MBTL1KDM4EP4HBNPSR1
SCHEMBL7976320 0.91 HTT (0.40) HTTL3MBTL1MEN1KMT2ARHOC
SCHEMBL7975920 0.89 HTT (0.40) HTTL3MBTL1NPSR1MEN1KMT2A
SCHEMBL7976362 0.87 HTT (0.41) HTTKDM4EMEN1KMT2ARHOC
SCHEMBL8408710 0.86 HTT (0.44) HTTL3MBTL1KDM4EP4HBNPSR1
SCHEMBL7976269 0.85 HTT (0.40) HTTNPSR1MEN1KMT2ARHOC
SCHEMBL7979223 0.84 NPC1 (0.45) L3MBTL1KMT2ARHOCRHOAALDH1A1
SCHEMBL8408372 0.84 HTT (0.44) HTTL3MBTL1KDM4EMEN1KMT2A

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-6214835-B1 CONTROLLING INSECTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-04-10 US disclosed