SCHEMBL18779776

SCHEMBL18779776

CCCCCc1ccc(-c2ccc(-c3ccc(-c4ccc(CC)c(F)c4F)c(F)c3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RARB P10826 11/20 0.55
RARA P10276 2/20 0.55
RARG P13631 1/20 0.55
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
MTOR P42345 1/20 0.43
KMT2A Q03164 1/20 0.43
MPL P40238 3/20 0.42
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40
HTR2A P28223 1/20 0.40
HRH3 Q9Y5N1 1/20 0.38
LPL P06858 1/20 0.38
LIPG Q9Y5X9 1/20 0.38
GPR84 Q9NQS5 1/20 0.38

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
SCHEMBL15164264 0.92 RARB (0.55) RARBRARARARGMEN1ALDH1A1
SCHEMBL19722146 0.92 RARB (0.52) RARBRARARARGMEN1ALDH1A1
SCHEMBL18779783 0.92 RARB (0.52) RARBRARARARGMEN1ALDH1A1
SCHEMBL18779780 0.91 RARB (0.57) RARBRARARARGMEN1ALDH1A1
SCHEMBL16377221 0.91 RARB (0.43) RARBRARARARGMPLHSD17B10
SCHEMBL18779779 0.88 RARB (0.47) RARBRARARARGMPLTSHR
SCHEMBL18671225 0.88 RARB (0.59) RARBRARARARGMEN1ALDH1A1
SCHEMBL17551841 0.86 RARB (0.52) RARBRARARARGMEN1ALDH1A1
SCHEMBL18779777 0.83 CTSL (0.41) RARBRARARARGMAPTMPL
SCHEMBL16377223 0.83 CTSL (0.41) RARBRARARARGMAPTMPL

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