SCHEMBL9256934

SCHEMBL9256934

O=S(=O)(c1[nH]c(-c2ccc(Cl)c(Cl)c2)c(Br)c1Br)C(F)(Cl)Cl

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.34
EPAS1 Q99814 1/20 0.34
MEN1 O00255 2/20 0.32
HTT P42858 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
USP2 O75604 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
PKM P14618 1/20 0.32
ALOX12 P18054 1/20 0.32
PTGS2 P35354 6/20 0.32
PTGS1 P23219 3/20 0.32
IKBKB O14920 1/20 0.31
CYP1B1 Q16678 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30
SCN9A Q15858 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
SCHEMBL9257029 0.78 EPAS1 (0.36) AHREPAS1MEN1HTTKMT2A
SCHEMBL9258502 0.75 AHR (0.36) AHRMEN1HTTKMT2AKDM4E
SCHEMBL8668183 0.74 PTGS2 (0.35) EPAS1PTGS2PTGS1
SCHEMBL9259250 0.73 EPAS1 (0.36) AHREPAS1MEN1HTTKMT2A
SCHEMBL9258499 0.72 AHR (0.36) AHRMEN1HTTKMT2AKDM4E
SCHEMBL8799220 0.71 AHR (0.38) AHRMEN1HTTKMT2AKDM4E
SCHEMBL9339859 0.66 PSD (0.41) AHRMEN1HTTKMT2AKDM4E
SCHEMBL9227995 0.65 AHR (0.41) AHRMEN1HTTKMT2AKDM4E
SCHEMBL8780034 0.64 PTGS2 (0.34) EPAS1PTGS2PTGS1
SCHEMBL8483151 0.63 AHR (0.42) AHRMEN1HTTKMT2AKDM4E

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
US-5378724-A Insecticide. miticide, nematocide BAYER AKTIENGESELLSCHAFT (DE) 1995-01-03 US disclosed
EP-0591806-A1 Substituted 2-arylpyrroles BAYER AG (DE) 1994-04-13 EP disclosed