SCHEMBL10534085

SCHEMBL10534085

CCCCCc1ccc(-c2ccc(-c3ccc(CC)cc3)c(F)c2F)cc1.CCCCCc1ccc(-c2ccc(-c3ccc(CCC)cc3)c(F)c2F)cc1.CCCCCc1ccc(-c2ccc(-c3ccc(CCCC)cc3)c(F)c2F)cc1.CCCCCc1ccc(-c2ccc(-c3ccc(CCCCC)cc3)c(F)c2F)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 9/20 0.49
FAAH O00519 1/20 0.44
MPL P40238 3/20 0.44
HSD11B1 P28845 2/20 0.43
HSD17B10 Q99714 2/20 0.43
TSHR P16473 1/20 0.43
RARA P10276 2/20 0.43
RARG P13631 1/20 0.43
ESR1 P03372 2/20 0.42
ADRA2A P08913 2/20 0.42
ADORA3 P0DMS8 2/20 0.42
TACR2 P21452 2/20 0.42
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 2/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
SHBG P04278 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL9494755 0.95 RARB (0.52) RARBFAAHMPLHSD11B1HSD17B10
SCHEMBL9495358 0.94 RARB (0.55) RARBFAAHHSD11B1HSD17B10TSHR
SCHEMBL18779835 0.94 RARB (0.51) RARBFAAHMPLHSD11B1HSD17B10
SCHEMBL15682610 0.94 MPL (0.47) RARBFAAHMPLHSD11B1HSD17B10
SCHEMBL9494695 0.94 RARB (0.54) RARBFAAHMPLHSD11B1HSD17B10
SCHEMBL9563690 0.92 RARB (0.53) RARBFAAHHSD11B1HSD17B10TSHR
SCHEMBL9493991 0.92 RARB (0.56) RARBFAAHHSD11B1HSD17B10TSHR
SCHEMBL9497269 0.92 RARB (0.56) RARBFAAHHSD11B1HSD17B10TSHR
SCHEMBL9494324 0.92 RARB (0.56) RARBFAAHHSD11B1HSD17B10TSHR
SCHEMBL9497740 0.92 RARB (0.56) RARBFAAHHSD11B1HSD17B10TSHR

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
WO-1989002425-A1 FLUORINATED OLIGOPHENYLS AND THEIR USE IN LIQUID CRYSTAL MATERIALS MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1989-03-23 WO disclosed