SCHEMBL7982287

SCHEMBL7982287

FC(F)(F)c1ccc(Cl)c(NCCCOc2c(Cl)cc(OCC=C(Cl)Cl)cc2Cl)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
CYP1A2 P05177 5/20 0.36
CYP2C19 P33261 5/20 0.36
CYP3A4 P08684 4/20 0.36
CYP2D6 P10635 3/20 0.36
MEN1 O00255 5/20 0.35
KMT2A Q03164 5/20 0.35
MAPT P10636 3/20 0.35
CYP2C9 P11712 1/20 0.35
ALDH1A1 P00352 7/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MCL1 Q07820 2/20 0.34
HTT P42858 1/20 0.34
LMNA P02545 1/20 0.34
KDM4E B2RXH2 2/20 0.34
HPGD P15428 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL7979279 0.90 MAPT (0.36) CYP1A2CYP2C19CYP3A4CYP2D6MEN1
SCHEMBL7965745 0.90 MAPT (0.35) CYP1A2CYP2C19CYP3A4CYP2D6MEN1
SCHEMBL8408424 0.88 HTT (0.38) ALDH1A1SMN1; SMN2HTTLMNAHPGD
SCHEMBL7976379 0.86 HDAC1 (0.39) HDAC1HDAC8CYP1A2CYP2C19CYP3A4
SCHEMBL7976345 0.86 LMNA (0.36) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL8659999 0.85 HTT (0.37) HDAC1HTTKDM4E
SCHEMBL7976268 0.85 MAPT (0.56) CYP1A2CYP2C19CYP3A4CYP2D6MEN1
SCHEMBL8631007 0.85 RHOC (0.38) ALDH1A1SMN1; SMN2HTTLMNAHPGD
SCHEMBL7073001 0.84 PRKAB2 (0.38) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL7965854 0.82 HTT (0.35) HTT

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