SCHEMBL6897375

SCHEMBL6897375

CCCc1ccc(CCc2ccc(-c3ccc(CC)cc3)cc2F)c(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.40
RARA P10276 2/20 0.40
RARG P13631 1/20 0.40
TAAR1 Q96RJ0 2/20 0.35
ALOX5 P09917 1/20 0.35
CYP17A1 P05093 3/20 0.34
CYP11B1 P15538 2/20 0.34
CYP11B2 P19099 2/20 0.34
MCL1 Q07820 1/20 0.34
NPC1 O15118 1/20 0.34
TP53 P04637 1/20 0.34
PKM P14618 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KIF11 P52732 1/20 0.33
FAAH O00519 1/20 0.32
CTSL P07711 1/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32

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
SCHEMBL16377214 0.94 RARB (0.43) RARBRARARARGTAAR1ALOX5
SCHEMBL10301937 0.91 RARB (0.44) RARBRARARARGTAAR1ALOX5
SCHEMBL12735619 0.91 RARB (0.37) RARBRARARARGTAAR1ALOX5
SCHEMBL10301940 0.89 RARB (0.45) RARBRARARARGTAAR1ALOX5
SCHEMBL9663272 0.89 RARB (0.43) RARBRARARARGTAAR1ALOX5
SCHEMBL11996454 0.89 RARB (0.43) RARBRARARARGTAAR1ALOX5
SCHEMBL6889224 0.87 TAAR1 (0.39) RARBRARARARGTAAR1ALOX5
SCHEMBL16377229 0.87 CTSL (0.40) RARBRARARARGTAAR1ALOX5
SCHEMBL10301941 0.87 RARB (0.46) RARBRARARARGTAAR1MCL1
SCHEMBL16377219 0.86 ALOX5 (0.40) RARBRARARARGTAAR1ALOX5

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
EP-0945418-B1 LIQUID CRYSTAL COMPOUNDS EXHIBITING NEGATIVE ANISOTROPY OF PERMITTIVITY, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAYS CHISSO CORP (JP) 2004-04-07 EP disclosed
US-6210761-B1 HIGH VOLTAGE HOLDING RATIO AND A LOW THRESHOLD VOLTAGE, ARE REMARKABLY SMALL IN THEIR DEPENDENCY ON TEMPERATURE, HARDLY EXHIBIT SMECTIC PHASE, AND ARE EXCELLENT IN MISCIBILITY WITH OTHER LIQUID CRYSTAL MATERIALS CHISSO CORPORATION (JP) 2001-04-03 US disclosed
EP-0945418-A1 LIQUID CRYSTAL COMPOUNDS EXHIBITING NEGATIVE ANISOTROPY OF PERMITTIVITY, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAYS CHISSO CORPORATION (JP) 1999-09-29 EP disclosed