SCHEMBL18779779

SCHEMBL18779779

CCCCc1ccc(-c2ccc(-c3ccc(-c4ccc(CCC)c(F)c4F)c(F)c3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RARB P10826 8/20 0.47
RARA P10276 1/20 0.47
RARG P13631 1/20 0.47
MPL P40238 8/20 0.40
CTSL P07711 1/20 0.39
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
TSHR P16473 2/20 0.35
HSD17B10 Q99714 1/20 0.35
NPC1 O15118 1/20 0.35
TP53 P04637 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL19722146 0.96 RARB (0.52) RARBRARARARGMPLCTSL
SCHEMBL18779783 0.96 RARB (0.52) RARBRARARARGMPLCTSL
SCHEMBL16377223 0.93 CTSL (0.41) RARBRARARARGMPLCTSL
SCHEMBL18779777 0.93 CTSL (0.41) RARBRARARARGMPLCTSL
SCHEMBL18779781 0.91 RARB (0.49) RARBRARARARGMPLCTSL
SCHEMBL15164264 0.91 RARB (0.55) RARBRARARARGTSHRHSD17B10
SCHEMBL16377229 0.89 CTSL (0.40) RARBRARARARGCTSLCTSS
SCHEMBL18779776 0.88 RARB (0.55) RARBRARARARGMPLTSHR
SCHEMBL18671223 0.87 RARB (0.50) RARBRARARARGMPLCA1
SCHEMBL9495393 0.87 RARB (0.44) RARBRARARARGMPLCTSL

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 3 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
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