SCHEMBL22361237

SCHEMBL22361237

O=C1C(Br)=Cc2ccc(Br)c3cccc1c23

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.64
MAPT P10636 2/20 0.64
KMT2A Q03164 2/20 0.64
MAPK1 P28482 1/20 0.64
CYP1B1 Q16678 14/20 0.43
ALDH1A1 P00352 3/20 0.40
POLB P06746 2/20 0.40
RXFP1 Q9HBX9 1/20 0.40
CES2 O00748 1/20 0.39
BCHE P06276 1/20 0.39
CES1 P23141 1/20 0.39
MCL1 Q07820 1/20 0.39
CYP1A2 P05177 1/20 0.39
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
LMNA P02545 1/20 0.37
PABPC1 P11940 1/20 0.37

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
SCHEMBL28962249 0.83 MEN1 (0.44) MEN1MAPTKMT2AMAPK1CYP1B1
SCHEMBL28928982 0.80 MAOA (0.45) MEN1MAPTKMT2AMAPK1CYP1B1
SCHEMBL29583035 0.79 CYP1B1 (0.61) MEN1MAPTKMT2ACYP1B1ALDH1A1
SCHEMBL77179 0.79 CYP1B1 (0.61) MEN1MAPTKMT2ACYP1B1ALDH1A1
SCHEMBL16225115 0.78 MEN1 (1.00) MEN1MAPTKMT2AMAPK1ALDH1A1
SCHEMBL30184802 0.78 MEN1 (1.00) MEN1MAPTKMT2AMAPK1ALDH1A1
SCHEMBL28928981 0.77 MEN1 (0.44) MEN1MAPTKMT2AMAPK1CYP1B1
SCHEMBL29095873 0.76 ALDH1A1 (0.40) MEN1MAPTKMT2AMAPK1CYP1B1
SCHEMBL10350796 0.74 PABPC1 (0.58) MEN1MAPTKMT2ACYP1B1ALDH1A1
SCHEMBL28938488 0.74 CYP1B1 (0.44) MEN1MAPTKMT2ACYP1B1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3699224-A1 SCORCH RETARDANT HALOGENATED FLAME RETARDANT COMPOUNDS AND ARTICLES MADE THEREFROM PolyOne Corporation (US) 2020-08-26 EP disclosed