SCHEMBL855077

SCHEMBL855077

O=C1OCc2c1cc(Br)c(Br)c2Br

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 9/20 0.39
MAOA P21397 4/20 0.36
MAOB P27338 4/20 0.36
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
KCNJ1 P48048 2/20 0.35
CYP3A4 P08684 1/20 0.34
KCNH2 Q12809 1/20 0.34
PDE1A P54750 1/20 0.33
PDE1B Q01064 1/20 0.33
PDE3B Q13370 1/20 0.33
PDE1C Q14123 1/20 0.33
PDE3A Q14432 1/20 0.33

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
SCHEMBL855972 0.76 MAOA (0.40) ALOX5MAOAMAOBLMNAGAA
SCHEMBL855079 0.76 KCNJ1 (0.46) ALOX5MAOAMAOBLMNAGAA
SCHEMBL855164 0.73 MAOA (0.38) ALOX5MAOAMAOBLMNAGAA
SCHEMBL26118044 0.73 LMNA (0.38) ALOX5MAOAMAOBLMNAGAA
SCHEMBL26112753 0.73 LMNA (0.41) ALOX5MAOAMAOBLMNAGAA
SCHEMBL855921 0.72 NUAK1 (0.35) ALOX5GAA
SCHEMBL286354 0.72 KCNJ1 (0.46) ALOX5MAOAMAOBLMNAKCNJ1
SCHEMBL855514 0.71 CYP3A4 (0.53) MAOAMAOBLMNAGAAMAPT
SCHEMBL698199 0.69 PIM1 (0.48) ALOX5MAOAMAOBLMNAGAA
SCHEMBL23513349 0.69 KCNJ1 (0.44) ALOX5LMNAGAAKCNJ1CYP3A4

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 6 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
CN-105849094-B The manufacture method of halogen-substituted phthalein 住友化学株式会社 2018-04-10 CN disclosed
CN-105849094-A Method for producing halogen-substituted phthalide 住友化学株式会社 2016-08-10 CN 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