SCHEMBL7553151

SCHEMBL7553151

C=CCc1ccc2cc(-c3ccc(CCCCCC(C)F)cc3)ccc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.38
RARB P10826 3/20 0.34
SIGMAR1 Q99720 2/20 0.34
RARA P10276 1/20 0.34
RARG P13631 1/20 0.34
ALOX5 P09917 3/20 0.33
HRH3 Q9Y5N1 3/20 0.33
ALDH1A1 P00352 3/20 0.33
PPARG P37231 2/20 0.33
PPARD Q03181 2/20 0.33
GRIN2D O15399 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
PPARA Q07869 1/20 0.33
CNR2 P34972 4/20 0.32
GABRA1 P14867 3/20 0.32
GABRB2 P47870 3/20 0.32
XDH P47989 1/20 0.32
TP53 P04637 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
SCHEMBL7558904 0.95 HRH3 (0.36) PTGS2RARBSIGMAR1RARARARG
SCHEMBL8603247 0.91 GRIN2D (0.39) SIGMAR1ALOX5ALDH1A1PPARGPPARD
SCHEMBL7560812 0.88 TSHR (0.38) PTGS2RARBSIGMAR1RARARARG
SCHEMBL8603393 0.88 TSHR (0.38) PTGS2RARBSIGMAR1RARARARG
SCHEMBL8596925 0.86 RAB9A (0.41) ALDH1A1CNR2TP53SMN1; SMN2FFAR4
SCHEMBL7559220 0.86 CNR2 (0.33) PTGS2ALOX5CNR2GABRA1GABRB2
SCHEMBL7549802 0.86 RARB (0.36) RARBALDH1A1PPARGPPARDGRIN2D
SCHEMBL7558650 0.85 RAB9A (0.36) ALOX5ALDH1A1CNR2GABRA1GABRB2
SCHEMBL8597081 0.85 PTGS2 (0.31) PTGS2CNR2
SCHEMBL8601971 0.84 RAB9A (0.35) RARBALDH1A1GRIN2DGRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0708165-B1 Liquid crystal, liquid crystal mixture and liquid crystal device comprising the same SUMITOMO CHEMICAL CO (JP) 2002-01-09 EP disclosed
US-6246452-B1 FERROELECTRIC CHIRAL SMECTIC LIQUID CRYSTAL MIXTURE HAVING IMPROVED RESPONSE SPEED WHICH CAN BE USED AS AN OPTICAL SHUTTER OR DISPLAY DEVICE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-06-12 US disclosed
EP-0667384-B1 Fluorine-containing optically active compound, process for preparing the same and liquid crystal mixture and liquid crystal element comprising the same SUMITOMO CHEMICAL CO (JP) 1998-12-16 EP disclosed
US-5779934-A FLUORINATING AN ALCOHOL DERIVATIVE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-07-14 US disclosed
EP-0708165-A1 Liquid crystal, liquid crystal mixture and liquid crystal device comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-04-24 EP disclosed
EP-0667384-A1 Fluorine-containing optically active compound, process for preparing the same and liquid crystal mixture and liquid crystal element comprising the same SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-08-16 EP disclosed