SCHEMBL9723220

SCHEMBL9723220

CCCCCOc1ccc(C=O)c(F)c1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.42
GAA P10253 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 3/20 0.41
HPGD P15428 2/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
THRB P10828 2/20 0.39
THRA P10827 1/20 0.39
S1PR2 O95136 1/20 0.38
S1PR1 P21453 1/20 0.38
S1PR3 Q99500 1/20 0.38
LPAR2 Q9HBW0 1/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
NR1I2 O75469 1/20 0.38
LMNA P02545 1/20 0.38
CHRM2 P08172 1/20 0.38
CYP3A4 P08684 1/20 0.38
ADRA2A P08913 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
SCHEMBL9723167 0.98 L3MBTL1 (0.41) L3MBTL1GAATDP1ALDH1A1HPGD
SCHEMBL10008733 0.98 L3MBTL1 (0.41) L3MBTL1GAATDP1ALDH1A1HPGD
SCHEMBL30485468 0.95 L3MBTL1 (0.47) L3MBTL1GAATDP1ALDH1A1HPGD
SCHEMBL17578004 0.95 L3MBTL1 (0.47) L3MBTL1GAATDP1ALDH1A1HPGD
SCHEMBL9723174 0.90 ALDH1A1 (0.43) L3MBTL1GAATDP1ALDH1A1HPGD
SCHEMBL2544586 0.84 LMNA (0.49) L3MBTL1GAATDP1ALDH1A1HPGD
SCHEMBL8767442 0.84 ALDH1A1 (0.50) L3MBTL1GAATDP1ALDH1A1HPGD
SCHEMBL15120785 0.82 L3MBTL1 (0.48) L3MBTL1GAATDP1ALDH1A1HPGD
SCHEMBL3118609 0.81 GAA (0.43) L3MBTL1GAATDP1ALDH1A1HPGD
SCHEMBL19160557 0.81 NR5A1 (0.50) L3MBTL1ALDH1A1HPGDTHRBTHRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1216881-C Liquid crystal compound and its producing method UNIV TSINGHUA (CN) 2005-08-31 CN disclosed
CN-1511836-A Liquid crystal compound and its producing method 清华大学 2004-07-14 CN disclosed
US-5087764-A Deprotonation of a 1-substituted-2,3-difluorobenzene using an organometallic compound and reacting the reaction product with an electrophile Merck Patent Gesellschaft mit beschrankter Hafung (DE) 1992-02-11 US disclosed