SCHEMBL16258015

SCHEMBL16258015

CCCCCc1ccc(-c2ccc(F)c(F)c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 10/20 0.66
RARA P10276 2/20 0.66
RARG P13631 1/20 0.66
HTR2A P28223 1/20 0.52
HSD17B10 Q99714 3/20 0.51
TSHR P16473 1/20 0.51
ALDH1A1 P00352 3/20 0.50
MEN1 O00255 2/20 0.50
MAPT P10636 2/20 0.50
KMT2A Q03164 2/20 0.50
MTOR P42345 1/20 0.50
CYP17A1 P05093 1/20 0.49
CYP11B1 P15538 1/20 0.49
CYP11B2 P19099 1/20 0.49
HRH3 Q9Y5N1 1/20 0.47
ESR1 P03372 2/20 0.47
ADRA2A P08913 2/20 0.47
ADORA3 P0DMS8 2/20 0.47
TACR2 P21452 2/20 0.47
SLC6A2 P23975 2/20 0.47

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
SCHEMBL16258039 1.00 RARB (0.66) RARBRARARARGHTR2AHSD17B10
SCHEMBL16258029 1.00 RARB (0.66) RARBRARARARGHTR2AHSD17B10
SCHEMBL11035363 0.98 RARB (0.68) RARBRARARARGHTR2AHSD17B10
SCHEMBL8375678 0.98 RARB (0.64) RARBRARARARGHTR2AHSD17B10
SCHEMBL16258119 0.95 RARB (0.59) RARBRARARARGHTR2AHSD17B10
SCHEMBL3611490 0.95 RARB (0.59) RARBRARARARGHTR2AHSD17B10
SCHEMBL16258012 0.95 RARB (0.59) RARBRARARARGHTR2AHSD17B10
SCHEMBL10379732 0.94 RARB (0.59) RARBRARARARGHTR2AHSD17B10
SCHEMBL9329602 0.93 RARB (0.57) RARBRARARARGHTR2AHSD17B10
SCHEMBL16258037 0.92 RARB (0.58) RARBRARARARGHTR2AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3512920-B1 LIQUID CRYSTAL MEDIUM AND LIQUID CRYSTAL DEVICE MERCK PATENT GMBH (DE) 2020-11-04 EP disclosed
US-20160024383-A1 LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME DIC CORPORATION (JP) 2016-01-28 US disclosed
US-20160024383-A1 LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME DIC CORPORATION (JP) 2016-01-28 US disclosed
EP-2806011-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME DIC Corporation (JP) 2014-11-26 EP disclosed