SCHEMBL7935587

SCHEMBL7935587

Fc1ccc(Sc2ccc(OC(Cl)(Cl)Cl)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 4/20 0.42
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
MAPT P10636 4/20 0.39
ALDH1A1 P00352 3/20 0.36
HTT P42858 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
STS P08842 1/20 0.34
NPSR1 Q6W5P4 3/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
GAA P10253 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GPR3 P46089 1/20 0.32
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NFE2L2 Q16236 1/20 0.31

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 0.87 GAA (0.39) CHRNA7GAAGPR3NFE2L2
SCHEMBL7940692 0.82 CHRNA7 (0.52) CHRNA7MEN1KMT2AMAPTALDH1A1
SCHEMBL7937281 0.81 SOS1 (0.44) MEN1KMT2AALDH1A1HTTL3MBTL1
SCHEMBL7937974 0.81 NPC1 (0.36) MAPTL3MBTL1GAANFE2L2
SCHEMBL7938025 0.80 NR1H2 (0.56) MEN1KMT2AMAPTALDH1A1STS
SCHEMBL7940685 0.76 LMNA (0.41) KMT2AL3MBTL1LMNAMAPK1
SCHEMBL10712854 0.75 MEN1 (0.34) MEN1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL576260 0.75 MEN1 (0.48) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL7929138 0.74 HPGD (0.35) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL7937295 0.73 ESR1 (0.41) CYP2C9CYP2C19GAAGPR3CYP3A4

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