SCHEMBL855171

SCHEMBL855171

O=C1OCc2c1cc(Cl)c(Cl)c2F

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.36
KCNJ1 P48048 3/20 0.36
MAOA P21397 7/20 0.34
MAOB P27338 7/20 0.34
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
KCNH2 Q12809 1/20 0.32

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
SCHEMBL855938 0.83 ALOX5 (0.39) ALOX5KCNJ1MAOAMAOBLMNA
SCHEMBL861759 0.76 MAOA (0.38) ALOX5KCNJ1MAOAMAOBLMNA
SCHEMBL855294 0.76 MAOA (0.38) ALOX5KCNJ1MAOAMAOBLMNA
SCHEMBL854099 0.76 ALOX5 (0.39) ALOX5KCNJ1MAOAMAOBLMNA
SCHEMBL23513237 0.75 KCNJ1 (0.42) ALOX5KCNJ1MAOAMAOBLMNA
SCHEMBL23496874 0.75 ALOX5 (0.36) ALOX5KCNJ1MAOAMAOBLMNA
SCHEMBL29812975 0.75 ALOX5 (0.36) ALOX5KCNJ1MAOAMAOBLMNA
SCHEMBL23496800 0.75 MAPT (0.40) ALOX5KCNJ1MAOAMAOBLMNA
SCHEMBL855719 0.72 ALOX5 (0.42) ALOX5MAOAMAOB
SCHEMBL855516 0.71 EPAS1 (0.34) ALOX5

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-2433933-B1 PRODUCTION METHOD OF TRI- OR TETRAHALOGEN-SUBSTITUTED PHTHALIDE SUMITOMO CHEMICAL CO (JP) 2019-05-08 EP disclosed
US-8604221-B2 Production method of halogen-substituted phthalide SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-12-10 US disclosed
US-20120142946-A1 PRODUCTION METHOD OF HALOGEN-SUBSTITUTED PHTHALIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-06-07 US disclosed
EP-2433933-A1 PRODUCTION METHOD OF HALOGEN-SUBSTITUTED PHTHALIDE Sumitomo Chemical Company, Limited (JP) 2012-03-28 EP disclosed