SCHEMBL8635247

SCHEMBL8635247

CCOc1ccc(Oc2ccc(OCc3ccccc3)c(C(C)C)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.53
PPARG P37231 1/20 0.46
PPARD Q03181 1/20 0.46
PPARA Q07869 1/20 0.46
LMNA P02545 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
FFAR1 O14842 2/20 0.44
TP53 P04637 1/20 0.43
PKM P14618 1/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.43
ALOX5 P09917 1/20 0.42
ACACB O00763 1/20 0.42
HTR1A P08908 1/20 0.42
ADRA1D P25100 1/20 0.42
ADRA1A P35348 1/20 0.42
ADRA1B P35368 1/20 0.42

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
SCHEMBL27774092 0.83 MAOB (0.55) LMNAL3MBTL1MRGPRX4ALOX5HTR1A
SCHEMBL11324524 0.81 LTA4H (0.74) LTA4HPPARGPPARDPPARALMNA
SCHEMBL2868493 0.80 LTA4H (0.51) LTA4HPPARGPPARDPPARALMNA
SCHEMBL8636209 0.79 LTA4H (0.50) LTA4HPPARGPPARDPPARALMNA
SCHEMBL25146420 0.77 MAPK1 (0.53) LTA4HLMNAL3MBTL1SMN1; SMN2ALOX5
SCHEMBL8798351 0.77 GLRA1 (0.49) LMNAL3MBTL1PKMSMN1; SMN2GLRA1
SCHEMBL8800593 0.77 GLRA1 (0.50) LMNAL3MBTL1SMN1; SMN2GLRA1CYP1A2
SCHEMBL13957662 0.77 MAPT (0.50) LMNAL3MBTL1SMN1; SMN2MRGPRX4GLRA1
SCHEMBL12889910 0.77 GLRA1 (0.50) LMNAL3MBTL1SMN1; SMN2MRGPRX4ALOX5
SCHEMBL11856497 0.76 LTA4H (0.78) LTA4HPPARGPPARDPPARALMNA

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