SCHEMBL8635018

SCHEMBL8635018

CC(C)c1cc(Oc2ccc(Oc3ccccc3)cc2)ccc1OCC=C(Cl)Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.40
RORC P51449 2/20 0.40
LTA4H P09960 2/20 0.40
BCL2 P10415 1/20 0.38
MCL1 Q07820 1/20 0.38
HTT P42858 2/20 0.36
HTR1D P28221 1/20 0.36
HTR1B P28222 1/20 0.36
PTGS1 P23219 1/20 0.36
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
RECQL P46063 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MAOB P27338 1/20 0.35
AOC3 Q16853 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL8636192 0.92 FFAR4 (0.40) THRBRORCMEN1CYP1A2CYP3A4
SCHEMBL8632642 0.90 LTA4H (0.42) THRBRORCLTA4HHTTMEN1
SCHEMBL8638487 0.89 THRB (0.40) THRBRORCHTTMAOBAOC3
SCHEMBL8635821 0.89 MEN1 (0.46) THRBRORCMEN1CYP1A2CYP3A4
SCHEMBL8635966 0.89 THRB (0.39) THRBRORCHTTCYP1A2CYP2C19
SCHEMBL8635020 0.87 LTA4H (0.40) THRBRORCLTA4HBCL2MCL1
SCHEMBL8635790 0.87 PTGDR (0.37) THRBRORCHTTMEN1CYP1A2
SCHEMBL8635792 0.85 THRB (0.35) THRBRORCMCL1HTTMEN1
SCHEMBL8633877 0.84 THRB (0.39) THRBRORCHTTMEN1KMT2A
SCHEMBL8636900 0.82 THRB (0.39) THRBRORCHTTKMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0648729-B1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL CO (JP) 1998-07-15 EP disclosed
US-5698702-A INTERMEDIATES FOR INSECTICIDES, ACARICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-12-16 US disclosed
US-5530015-A Dihaloprene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient, and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-06-25 US disclosed
EP-0648729-A1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-04-19 EP disclosed