SCHEMBL6667588

SCHEMBL6667588

CCCCCCCCc1ccc(C(F)(F)OCCc2ccc(OC(F)(F)F)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.45
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
CYP3A4 P08684 2/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
MAPK1 P28482 1/20 0.42
CASP1 P29466 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SLCO1B3 Q9NPD5 1/20 0.42
SLCO1B1 Q9Y6L6 1/20 0.42
STS P08842 2/20 0.41
ALOX5 P09917 1/20 0.40
PPARG P37231 1/20 0.40
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
SLC6A4 P31645 3/20 0.40
SLC6A3 Q01959 3/20 0.40

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
SCHEMBL6664171 1.00 FAAH (0.45) FAAHALDH1A1LMNACYP3A4MEN1
SCHEMBL6662964 1.00 FAAH (0.45) FAAHALDH1A1LMNACYP3A4MEN1
SCHEMBL6667378 1.00 FAAH (0.45) FAAHALDH1A1LMNACYP3A4MEN1
SCHEMBL6666329 1.00 FAAH (0.45) FAAHALDH1A1LMNACYP3A4MEN1
SCHEMBL6663835 0.99 FAAH (0.43) FAAHALDH1A1LMNACYP3A4MEN1
SCHEMBL6663739 0.95 ALOX5 (0.41) FAAHALDH1A1LMNACYP3A4MEN1
SCHEMBL7734800 0.89 FAAH (0.49) FAAHALDH1A1LMNACYP3A4MEN1
SCHEMBL6666700 0.89 TSHR (0.41) ALDH1A1LMNAALOX5PPARGHDAC3
SCHEMBL7731004 0.89 FAAH (0.49) FAAHALDH1A1LMNACYP3A4MEN1
SCHEMBL7731696 0.89 FAAH (0.49) FAAHALDH1A1LMNACYP3A4MEN1

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