SCHEMBL7765300

SCHEMBL7765300

Fc1cc(Br)ccc1OC(F)(F)Cl

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.38
ALDH1A1 P00352 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PDE2A O00408 1/20 0.37
EPHX2 P34913 1/20 0.37
SLC6A4 P31645 2/20 0.35
DGAT1 O75907 1/20 0.35
AAK1 Q2M2I8 2/20 0.34
KDM1A O60341 2/20 0.33
KDM1B Q8NB78 1/20 0.33
TSHR P16473 1/20 0.33
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
PKM P14618 1/20 0.32
NSD2 O96028 1/20 0.32
NSD3 Q9BZ95 1/20 0.32
EPAS1 Q99814 1/20 0.32

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
SCHEMBL29855116 0.84 EPHX2 (0.50) MAPK1ALDH1A1TDP1L3MBTL1PDE2A
SCHEMBL425877 0.84 EPHX2 (0.50) MAPK1ALDH1A1TDP1L3MBTL1PDE2A
SCHEMBL17476838 0.82 AAK1 (0.43) MAPK1ALDH1A1TDP1L3MBTL1PDE2A
SCHEMBL7807251 0.79 TRPV1 (0.40) MAPK1ALDH1A1TDP1L3MBTL1PDE2A
SCHEMBL9125985 0.77 PDE2A (0.37) MAPK1ALDH1A1TDP1PDE2AEPHX2
SCHEMBL24901470 0.77 USP28 (0.38) MAPK1L3MBTL1PDE2AEPHX2SLC6A4
SCHEMBL1044895 0.75 MAPK1 (0.43) MAPK1ALDH1A1TDP1L3MBTL1SLC6A4
SCHEMBL7911138 0.75 RECQL (0.42) MAPK1ALDH1A1TDP1L3MBTL1PDE2A
SCHEMBL27266032 0.74 MAPK1 (0.58) MAPK1ALDH1A1TDP1L3MBTL1SLC6A4
SCHEMBL9804244 0.74 MAPT (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6263678-A None JP disclosed
EP-0727428-B1 Novel silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions SHINETSU CHEMICAL CO (JP) 2001-06-06 EP disclosed
US-5665271-A Silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions SHIN-ETSU CHEMICAL CO., LTD. (JP) 1997-09-09 US disclosed
EP-0727428-A1 Novel silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-08-21 EP disclosed
JP-H06263678-A CHLORODIFLUOROMETHOXYPHENYL DERIVATIVE F HOFFMANN LA ROCHE AG 1994-09-20 JP disclosed
US-4829074-A INSECTICIDES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1989-05-09 US disclosed
EP-0194064-A2 Azolyl substituted aralkyl compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-09-10 EP disclosed