SCHEMBL7937281

SCHEMBL7937281

Fc1ccc(Oc2ccc(OC(Cl)(Cl)Cl)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.44
HSPB1 P04792 1/20 0.44
SCN4A P35499 2/20 0.39
LTA4H P09960 2/20 0.39
EPHX2 P34913 1/20 0.39
GAA P10253 2/20 0.37
PPARA Q07869 3/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.36
PPARG P37231 2/20 0.36
PPARD Q03181 2/20 0.36
S1PR2 O95136 1/20 0.36
FFAR1 O14842 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
HTT P42858 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
PDE4A P27815 1/20 0.34

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
SCHEMBL7937961 0.93 GAA (0.39) SOS1HSPB1GAA
SCHEMBL7937974 0.86 NPC1 (0.36) SCN4AGAAL3MBTL1
SCHEMBL29375733 0.83 SOS1 (0.56) SOS1HSPB1SCN4ALTA4HEPHX2
SCHEMBL7940685 0.81 LMNA (0.41) LTA4HEPHX2KMT2AL3MBTL1LMNA
SCHEMBL7935587 0.81 CHRNA7 (0.42) GAAMEN1KMT2AKDM4EL3MBTL1
SCHEMBL10712854 0.80 MEN1 (0.34) EPHX2PPARAMEN1KMT2AKDM4E
SCHEMBL6289867 0.80 SOS1 (0.58) SOS1HSPB1SCN4ALTA4HEPHX2
SCHEMBL6290683 0.80 SOS1 (0.58) SOS1HSPB1SCN4ALTA4HEPHX2
SCHEMBL351854 0.80 SOS1 (0.58) SOS1HSPB1SCN4ALTA4HEPHX2
SCHEMBL7929138 0.79 HPGD (0.35) GAAPPARAMEN1KMT2APPARG

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-6242654-B1 REACTING A PHENOLATE COMPOUND WITH AN ORGANIC FLUORINATING AGENT TO PREPARE A FLUORINE SUBSTITUTED AROMATIC COMPOUND MITSUI CHEMICALS, INC. (JP) 2001-06-05 US disclosed
EP-1013629-A1 Preparation process of fluorine subsituted aromatic compound Mitsui Chemicals, Inc. (JP) 2000-06-28 EP disclosed