SCHEMBL5541239

SCHEMBL5541239

C=CCc1ccc(OC(C)(C)C)c(CO)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
PPARA Q07869 2/20 0.49
PPARG P37231 2/20 0.49
PPARD Q03181 2/20 0.49
ALOX5 P09917 5/20 0.45
PTGS1 P23219 2/20 0.45
CYP3A4 P08684 2/20 0.45
AR P10275 1/20 0.45
TRPM8 Q7Z2W7 1/20 0.45
GABRA1 P14867 8/20 0.44
GABRB2 P47870 8/20 0.44
CNR2 P34972 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
KDM4E B2RXH2 2/20 0.43
GAA P10253 2/20 0.43
MAPT P10636 2/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL8992679 0.83 ALDH1A1 (0.67) ALDH1A1PPARAPPARGPPARDALOX5
SCHEMBL5586111 0.78 ALDH1A1 (0.75) ALDH1A1PPARAPPARGPPARDALOX5
SCHEMBL332417 0.78 ALDH1A1 (0.69) ALDH1A1PPARAPPARGPPARDALOX5
SCHEMBL19248503 0.77 ALDH1A1 (0.46) ALDH1A1PPARAPPARGPPARDALOX5
SCHEMBL7110975 0.73 XDH (0.52) ALDH1A1PPARAPPARGPPARDALOX5
SCHEMBL22215940 0.72 MEN1 (0.46) ALDH1A1PPARAPPARGPPARDCYP3A4
SCHEMBL9999649 0.72 XDH (0.66) ALDH1A1PPARAPPARGPPARDALOX5
SCHEMBL4678573 0.70 XDH (0.48) ALDH1A1PPARAPPARGPPARDALOX5
SCHEMBL7984311 0.70 ALDH1A1 (0.47) ALDH1A1KDM4ELMNATDP1
SCHEMBL19248511 0.70 XDH (0.48) ALDH1A1PPARAPPARGPPARDALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140027683-A1 COLORED COMPOSITION, COLORED CURED FILM, COLOR FILTER, METHOD FOR PRODUCING COLOR FILTER, LIQUID CRYSTAL DISPLAY DEVICE, SOLID-STATE IMAGING DEVICE, AND NOVEL DIPYRROMETHENE METAL COMPLEX COMPOUND OR TAUTOMER THEREOF FUJIFILM CORPORATION (JP) 2014-01-30 US disclosed
US-8242221-B2 Half-metallocene catalyst compositions and their polymer products CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2012-08-14 US disclosed
US-20120108764-A1 HALF-METALLOCENE CATALYST COMPOSITIONS AND THEIR POLYMER PRODUCTS CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2012-05-03 US disclosed
US-8110640-B2 Half-metallocene catalyst compositions and their polymer products CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2012-02-07 US disclosed
US-20110065874-A1 HALF-METALLOCENE CATALYST COMPOSITIONS AND THEIR POLYMER PRODUCTS CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2011-03-17 US disclosed