SCHEMBL18779782

SCHEMBL18779782

CCCCCc1ccc(-c2ccc(-c3ccc(-c4ccc(CCC)c(F)c4F)cc3F)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 10/20 0.54
RARA P10276 2/20 0.48
RARG P13631 1/20 0.48
HSD17B10 Q99714 2/20 0.40
TSHR P16473 1/20 0.40
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
MTOR P42345 1/20 0.39
KMT2A Q03164 1/20 0.39
MPL P40238 3/20 0.39
HTR2A P28223 1/20 0.39
HSD11B1 P28845 2/20 0.37
HRH3 Q9Y5N1 1/20 0.37
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
ESR1 P03372 1/20 0.36
SHBG P04278 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 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
SCHEMBL18779781 0.96 RARB (0.49) RARBRARARARGMPLHSD11B1
SCHEMBL18779780 0.92 RARB (0.57) RARBRARARARGHSD17B10TSHR
SCHEMBL18779784 0.92 RARB (0.43) RARBRARARARGHSD17B10MPL
SCHEMBL9496950 0.92 RARB (0.48) RARBRARARARGHSD17B10TSHR
SCHEMBL18779783 0.91 RARB (0.52) RARBRARARARGHSD17B10TSHR
SCHEMBL19722146 0.91 RARB (0.52) RARBRARARARGHSD17B10TSHR
SCHEMBL9493602 0.91 RARB (0.50) RARBRARARARGHSD17B10TSHR
SCHEMBL9495430 0.91 RARB (0.50) RARBRARARARGHSD17B10TSHR
SCHEMBL9493556 0.91 RARB (0.50) RARBRARARARGHSD17B10TSHR
SCHEMBL9494190 0.91 RARB (0.50) RARBRARARARGHSD17B10TSHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170226419-A1 POLYMERIZABLE-MONOMER-CONTAINING LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME DIC CORPORATION (JP) 2017-08-10 US disclosed
EP-3159393-A1 POLYMERIZABLE-MONOMER-CONTAINING LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME DIC Corporation (JP) 2017-04-26 EP disclosed