SCHEMBL6661139

SCHEMBL6661139

CCCc1ccc(C(F)(F)OCCc2ccc(F)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TAAR1 Q96RJ0 3/20 0.37
KMT2A Q03164 2/20 0.36
HPGD P15428 1/20 0.36
ELOVL1 Q9BW60 1/20 0.35
IDO1 P14902 2/20 0.35
AGXT P21549 2/20 0.35
AOC3 Q16853 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35

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
SCHEMBL6661122 0.93 TAAR1 (0.37) ALDH1A1TAAR1KMT2AIDO1
SCHEMBL6667001 0.90 L3MBTL1 (0.45) ALDH1A1LMNAGAATAAR1KMT2A
SCHEMBL6663065 0.89 FAAH (0.42) ALDH1A1LMNAGAAKMT2AL3MBTL1
SCHEMBL6660763 0.89 TAAR1 (0.46) ALDH1A1TAAR1KMT2AIDO1
SCHEMBL6666031 0.89 TAAR1 (0.37) ALDH1A1TAAR1IDO1L3MBTL1
SCHEMBL6662747 0.86 FAAH (0.44) ALDH1A1LMNAKMT2A
SCHEMBL6661962 0.86 FAAH (0.44) ALDH1A1LMNAKMT2A
SCHEMBL6665130 0.85 TAAR1 (0.33) ALDH1A1GAATAAR1IDO1L3MBTL1
SCHEMBL6662178 0.85 TAAR1 (0.33) ALDH1A1LMNAGAATDP1TAAR1
SCHEMBL6666700 0.83 TSHR (0.41) 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