SCHEMBL9477803

SCHEMBL9477803

CC(=O)Oc1ccc(Br)c(O)c1Br

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFD P00746 2/20 0.44
PIM1 P11309 1/20 0.42
KDM4E B2RXH2 4/20 0.42
TSHR P16473 3/20 0.42
ALDH1A1 P00352 2/20 0.42
GAA P10253 1/20 0.42
RAB9A P51151 1/20 0.42
ERN1 O75460 1/20 0.40
LMNA P02545 1/20 0.39
PTGS1 P23219 2/20 0.39
PTGS2 P35354 2/20 0.39
ESR1 P03372 1/20 0.39
ITGB3 P05106 1/20 0.39
ITGA2B P08514 1/20 0.39
HMGB1 P09429 1/20 0.39
HPGD P15428 1/20 0.39
GGT1 P19440 1/20 0.39
BLM P54132 1/20 0.39
NAPRT Q6XQN6 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL17086902 0.78 CFD (0.48) CFDPIM1KDM4ETSHRALDH1A1
SCHEMBL6198267 0.77 MAPK1 (0.47) CFDPIM1KDM4ETSHRALDH1A1
SCHEMBL10442008 0.76 MAPK1 (0.50) CFDPIM1KDM4ETSHRALDH1A1
SCHEMBL3153215 0.75 KMT2A (0.50) TSHRGAALMNAESR1HPGD
SCHEMBL6699052 0.74 MAPK1 (0.49) CFDKDM4ETSHRALDH1A1GAA
SCHEMBL28427140 0.74 NCEH1 (0.50) CFDPIM1KDM4ETSHRALDH1A1
SCHEMBL12967710 0.74 CFD (0.46) CFDPIM1KDM4ETSHRALDH1A1
SCHEMBL5282613 0.74 CFD (0.42) CFDKDM4ETSHRALDH1A1GAA
SCHEMBL9807466 0.74 CFD (0.50) CFDPIM1KDM4ETSHRALDH1A1
SCHEMBL19462543 0.73 CFD (0.44) CFDPIM1KDM4ETSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4247048-A None JP disclosed
US-5204242-A Coupling component for colorimetric analysis of detection of oxidative coupling reaction; peroxide or peroxidase or aromatic amine detection BOEHRINGER MANNHEIM GMBH (DE) 1993-04-20 US disclosed
JP-H04247048-A SUBSTITUTED PHENOL, COLORIMETRIC ANALYZING METHOD FOR DETECTING OXIDATIVE COUPLING REACTION AND COUPLING COMPONENT BOEHRINGER MANNHEIM GMBH 1992-09-03 JP disclosed