SCHEMBL6662865

SCHEMBL6662865

CCCCCc1ccc(C(F)(F)OC(C)c2cc(F)c(F)c(F)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.39
FAAH O00519 1/20 0.38
RARB P10826 3/20 0.37
RARA P10276 1/20 0.37
RARG P13631 1/20 0.37
ESR1 P03372 2/20 0.36
ADRA2A P08913 2/20 0.36
ADORA3 P0DMS8 2/20 0.36
TACR2 P21452 2/20 0.36
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36
SLC6A3 Q01959 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
SHBG P04278 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
HSPD1 P10809 1/20 0.36
ADRB3 P13945 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
SCHEMBL6661194 0.91 HTR2A (0.36) HTR2AFAAHRARBRARARARG
SCHEMBL6662181 0.91 KMT2A (0.33) HTR2ASLC6A4LMNAADRA2C
SCHEMBL6663948 0.90 HTR2A (0.37) HTR2AFAAHRARBRARARARG
SCHEMBL6661953 0.89 HTR2A (0.35) HTR2AFAAHRARBRARARARG
SCHEMBL6662927 0.88 HSD17B10 (0.38) HTR2AFAAHRARBRARARARG
SCHEMBL6662209 0.88 HTR2A (0.34) HTR2AFAAHRARBRARARARG
SCHEMBL6662955 0.88 HTR2A (0.42) HTR2AFAAHESR1ADRA2AADORA3
SCHEMBL6666303 0.87 TRPV1 (0.36) HTR2AFAAHRARBRARARARG
SCHEMBL6663070 0.86 HTR2A (0.39) HTR2AFAAHESR1ADRA2AADORA3
SCHEMBL6661968 0.85 HTR2A (0.40) HTR2AFAAHESR1ADRA2AADORA3

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