SCHEMBL8995506

SCHEMBL8995506

CCC(=O)c1ccc(-c2ccc(Br)cc2F)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
POLB P06746 1/20 0.47
MMP1 P03956 1/20 0.46
MMP2 P08253 1/20 0.46
MMP3 P08254 1/20 0.46
MMP7 P09237 1/20 0.46
MMP9 P14780 1/20 0.46
MMP13 P45452 1/20 0.46
RARB P10826 1/20 0.45
ALDH1A1 P00352 3/20 0.44
HPGD P15428 2/20 0.44
TSHR P16473 2/20 0.44
GSK3B P49841 2/20 0.40
HAO1 Q9UJM8 1/20 0.40
DGAT1 O75907 1/20 0.39
ALOX5AP P20292 1/20 0.39
FEN1 P39748 1/20 0.39
ALOX5 P09917 1/20 0.38

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
SCHEMBL10694999 0.86 HTR7 (0.55) MMP1MMP2MMP3MMP7MMP9
SCHEMBL9060573 0.84 RARB (0.54) RARB
SCHEMBL5549813 0.83 MMP1 (0.49) MAPTSMN1; SMN2MMP1MMP2MMP3
SCHEMBL7862901 0.82 FFAR1 (0.51) L3MBTL1SMN1; SMN2MMP1MMP2MMP3
SCHEMBL8218301 0.81 MMP2 (0.50) MMP1MMP2MMP3MMP7MMP9
SCHEMBL13670550 0.80 HDAC1 (0.51) MAPTL3MBTL1MMP1MMP2MMP3
SCHEMBL8207287 0.80 MMP1 (0.49) MAPTL3MBTL1SMN1; SMN2MMP1MMP2
SCHEMBL8208555 0.80 DGAT1 (0.54) MAPTL3MBTL1MMP1MMP2MMP3
SCHEMBL10916811 0.79 CYP2C19 (0.51) MAPTL3MBTL1SMN1; SMN2RARBALDH1A1
SCHEMBL10924018 0.79 RARB (0.55) MAPTL3MBTL1SMN1; SMN2RARBALDH1A1

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
EP-0535635-B1 Tolane derivative, liquid crystal composition containing the derivative, and liquid crystal display device using the composition SEIKO EPSON CORP (JP) 1996-08-21 EP disclosed
US-5437815-A Blending with ordinary liquid crystal compounds broadens practical temperature range of composition and produces an enlarged double refraction anisotropy SEIKO EPSON CORPORATION (JP) 1995-08-01 US disclosed