SCHEMBL6575819

SCHEMBL6575819

FC(F)c1ccc(C(=C(Cl)Cl)c2ccc(Br)cc2)cc1Br

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
MAPT P10636 1/20 0.32
CYP1A2 P05177 1/20 0.31
GSK3B P49841 2/20 0.31
OGG1 O15527 1/20 0.30

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
SCHEMBL9494805 0.76 TSHR (0.59) MEN1KMT2ACYP3A4TSHRMAPK1
SCHEMBL5865631 0.74 NOTUM (0.53) MEN1KMT2ACYP3A4TSHRMAPK1
SCHEMBL21836896 0.74 TTR (0.45) MEN1KMT2ATSHRMAPK1L3MBTL1
SCHEMBL29624982 0.74 TTR (0.45) MEN1KMT2ATSHRMAPK1L3MBTL1
SCHEMBL5865578 0.72 MAPT (0.46) MEN1KMT2ACYP3A4TSHRMAPK1
SCHEMBL9494935 0.71 MEN1 (0.48) MEN1KMT2ACYP3A4TSHRMAPK1
SCHEMBL9494493 0.69 TSHR (0.77) MEN1KMT2ACYP3A4TSHRMAPK1
SCHEMBL25949222 0.69 NOTUM (0.58) MEN1KMT2ATSHRMAPK1ATM
SCHEMBL5865698 0.69 CCR2 (0.39) MEN1KMT2ACYP3A4TSHRMAPK1
SCHEMBL5865690 0.69 GPR35 (0.49) MEN1KMT2ATSHRMAPK1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1412311-A1 NOVEL TREATMENT OF ADRENOCORTICAL HYPERSECRETION AND TUMOUR GROWTH Brandt, Ingvar (SE) 2004-04-28 EP disclosed
WO-2003002495-A1 NOVEL TREATMENT OF ADRENOCORTICAL HYPERSECRETION AND TUMOUR GROWTH BRANDT INGVAR (SE) 2003-01-09 WO disclosed