SCHEMBL9699861

SCHEMBL9699861

CCCCCCCOc1cc[c]cc1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.44
THRA P10827 1/20 0.42
THRB P10828 1/20 0.42
TDP1 Q9NUW8 1/20 0.40
S1PR2 O95136 1/20 0.39
S1PR1 P21453 1/20 0.39
S1PR3 Q99500 1/20 0.39
LPAR2 Q9HBW0 1/20 0.39
MEN1 O00255 1/20 0.39
NR1I2 O75469 1/20 0.39
LMNA P02545 1/20 0.39
CHRM2 P08172 1/20 0.39
CYP3A4 P08684 1/20 0.39
ADRA2A P08913 1/20 0.39
MAPT P10636 1/20 0.39
OPRK1 P41145 1/20 0.39
HTR2B P41595 1/20 0.39
SLC6A3 Q01959 1/20 0.39
KMT2A Q03164 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39

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
SCHEMBL9699956 1.00 L3MBTL1 (0.44) L3MBTL1THRATHRBTDP1S1PR2
SCHEMBL1228883 1.00 L3MBTL1 (0.44) L3MBTL1THRATHRBTDP1S1PR2
SCHEMBL27294182 1.00 L3MBTL1 (0.44) L3MBTL1THRATHRBTDP1S1PR2
SCHEMBL27501834 0.98 L3MBTL1 (0.45) L3MBTL1THRATHRBTDP1S1PR2
SCHEMBL160012 0.93 L3MBTL1 (0.42) L3MBTL1THRATHRBTDP1S1PR2
SCHEMBL162033 0.88 L3MBTL1 (0.40) L3MBTL1THRATHRBTDP1MEN1
SCHEMBL5182869 0.87 L3MBTL1 (0.44) L3MBTL1THRATHRBTDP1MEN1
SCHEMBL5668680 0.87 L3MBTL1 (0.44) L3MBTL1THRATHRBTDP1MEN1
SCHEMBL3458097 0.84 NR5A1 (0.42) THRATHRBMEN1NR1I2LMNA
SCHEMBL17416897 0.84 NR5A1 (0.42) THRATHRBMEN1NR1I2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0517498-A1 Liquid crystal compounds and compositions SANYO CHEMICAL INDUSTRIES LTD. (JP) 1992-12-09 EP disclosed