SCHEMBL11209461

SCHEMBL11209461

CC(Br)(I)c1ccc(Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54
CYP19A1 P11511 7/20 0.43
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
HIF1A Q16665 1/20 0.42
LMNA P02545 1/20 0.42
CYP2A6 P11509 1/20 0.42
POLB P06746 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
SLC6A2 P23975 1/20 0.38
HTR2A P28223 1/20 0.38
SLC6A4 P31645 1/20 0.38
HRH1 P35367 1/20 0.38
HTR2B P41595 1/20 0.38
CHRNA4 P43681 1/20 0.38
SLC6A3 Q01959 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL20368835 0.81 MEN1 (0.56) KMT2AMEN1CYP19A1TSHRMAPK1
SCHEMBL95552 0.80 MEN1 (0.62) KMT2AMEN1CYP19A1TSHRMAPK1
SCHEMBL3656132 0.77 MEN1 (0.52) KMT2AMEN1CYP19A1TSHRMAPK1
SCHEMBL13379568 0.75 CYP19A1 (0.67) KMT2AMEN1CYP19A1TSHRMAPK1
SCHEMBL197202 0.75 MEN1 (0.62) KMT2AMEN1CYP19A1TSHRMAPK1
SCHEMBL2768675 0.75 MEN1 (0.62) KMT2AMEN1CYP19A1TSHRMAPK1
SCHEMBL1538386 0.75 MEN1 (0.62) KMT2AMEN1CYP19A1TSHRMAPK1
SCHEMBL31497682 0.75 MEN1 (0.62) KMT2AMEN1CYP19A1TSHRMAPK1
SCHEMBL677101 0.72 MEN1 (0.59) KMT2AMEN1CYP19A1TSHRMAPK1
SCHEMBL8322314 0.72 MEN1 (0.59) KMT2AMEN1CYP19A1TSHRMAPK1

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-0076722-A1 Process for the preparation of alpha-aryl-propionic acids and their alkaline salts Montedison S.p.A. (IT) 1983-04-13 EP disclosed