SCHEMBL6662973

SCHEMBL6662973

CCCCCCCCCc1ccc(COC(F)(F)Cc2ccc(OC(F)(F)F)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.46
ESR1 P03372 2/20 0.44
ADRA2A P08913 2/20 0.44
ADORA3 P0DMS8 2/20 0.44
TACR2 P21452 2/20 0.44
SLC6A2 P23975 2/20 0.44
SLC6A4 P31645 2/20 0.44
SLC6A3 Q01959 2/20 0.44
ALDH1A1 P00352 2/20 0.44
LMNA P02545 2/20 0.44
CYP3A4 P08684 2/20 0.44
KDM4E B2RXH2 1/20 0.44
SHBG P04278 1/20 0.44
TP53 P04637 1/20 0.44
HSPD1 P10809 1/20 0.44
ADRB3 P13945 1/20 0.44
HTR2C P28335 1/20 0.44
HSPE1 P61604 1/20 0.44
HIF1A Q16665 1/20 0.44
TST Q16762 1/20 0.44

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
SCHEMBL6666332 1.00 FAAH (0.46) FAAHESR1ADRA2AADORA3TACR2
SCHEMBL6667598 1.00 FAAH (0.46) FAAHESR1ADRA2AADORA3TACR2
SCHEMBL6667385 1.00 FAAH (0.46) FAAHESR1ADRA2AADORA3TACR2
SCHEMBL6664182 1.00 FAAH (0.46) FAAHESR1ADRA2AADORA3TACR2
SCHEMBL6663842 0.99 FAAH (0.43) FAAHESR1ADRA2AADORA3TACR2
SCHEMBL6666711 0.89 TSHR (0.42) SLC6A4SLC6A3ALDH1A1LMNAACHE
SCHEMBL6662961 0.89 ESR1 (0.50) FAAHESR1ADRA2AADORA3TACR2
SCHEMBL6666978 0.87 FAAH (0.48) FAAHESR1ADRA2AADORA3TACR2
SCHEMBL20746961 0.87 FAAH (0.57) FAAHESR1ADRA2AADORA3TACR2
SCHEMBL28264047 0.87 FAAH (0.57) FAAHESR1ADRA2AADORA3TACR2

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