SCHEMBL8656299

SCHEMBL8656299

O=C(OCCCOc1c(Cl)cc(OCC=C(Cl)Cl)cc1Cl)c1ccc(OCC(F)(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 8/20 0.41
HTT P42858 2/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPT P10636 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 1/20 0.35
PPARG P37231 4/20 0.35
PPARD Q03181 4/20 0.35
LMNA P02545 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
FFAR1 O14842 1/20 0.34
CYP2C9 P11712 1/20 0.34
SCN5A Q14524 1/20 0.34
FFAR4 Q5NUL3 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
SCHEMBL8658761 0.95 LMNA (0.39) PPARAHTTMEN1KMT2AMAPT
SCHEMBL8655977 0.88 PPARA (0.42) PPARAHTTMEN1KMT2AMAPT
SCHEMBL8408364 0.87 ALDH1A1 (0.50) HTTMEN1KMT2AMAPTNPC1
SCHEMBL8660357 0.86 PPARA (0.40) PPARAHTTMEN1KMT2AMAPT
SCHEMBL2350339 0.84 TDP1 (0.48) HTTKMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL8011673 0.82 HTT (0.40) PPARAHTTPPARGPPARDL3MBTL1
SCHEMBL7076143 0.82 L3MBTL1 (0.41) HTTMEN1KMT2AMAPTNPC1
SCHEMBL8665082 0.82 TDP1 (0.51) HTTMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL8660004 0.81 MAPT (0.51) HTTMEN1KMT2AMAPTNPC1
SCHEMBL8658676 0.81 PPARA (0.38) PPARAHTTMEN1KMT2AMAPT

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
EP-0722430-B1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL CO (JP) 1998-10-21 EP disclosed