SCHEMBL6661146

SCHEMBL6661146

CCCc1ccc(COC(F)(F)Cc2ccc(F)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
IDO1 P14902 2/20 0.40
AGXT P21549 2/20 0.40
MAOB P27338 3/20 0.38
TAAR1 Q96RJ0 3/20 0.38
KMT2A Q03164 2/20 0.36
HPGD P15428 1/20 0.36
AOC3 Q16853 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL6661132 0.93 LPL (0.38) ALDH1A1LMNAGAA
SCHEMBL6663073 0.89 ALDH1A1 (0.45) ALDH1A1LMNAGAAKMT2A
SCHEMBL6666035 0.88 TAAR1 (0.38) ALDH1A1GAATAAR1L3MBTL1
SCHEMBL6667004 0.86 LMNA (0.47) ALDH1A1LMNAGAAIDO1AGXT
SCHEMBL6660767 0.85 IDO1 (0.47) IDO1MAOBTAAR1KMT2A
SCHEMBL6661972 0.85 ESR1 (0.47) ALDH1A1LMNA
SCHEMBL6662752 0.85 ESR1 (0.47) ALDH1A1LMNA
SCHEMBL6665134 0.84 MAOA (0.35) ALDH1A1LMNAGAATDP1MAOB
SCHEMBL6662183 0.83 GPR84 (0.34) ALDH1A1LMNAGAATDP1MAOB
SCHEMBL6666711 0.83 TSHR (0.42) ALDH1A1LMNA

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-0893423-B1 LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORP (JP) 2004-09-01 EP disclosed