SCHEMBL2449264

SCHEMBL2449264

C=COCCOc1ccc(/C=C/C(=O)O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.53
THRB P10828 1/20 0.53
ATM Q13315 1/20 0.53
TBXAS1 P24557 2/20 0.52
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
HCAR2 Q8TDS4 2/20 0.46
CA12 O43570 1/20 0.46
AKR1B10 O60218 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
ESR1 P03372 1/20 0.46
CA3 P07451 1/20 0.46
PKM P14618 1/20 0.46
TYR P14679 1/20 0.46
AKR1B1 P15121 1/20 0.46
CA4 P22748 1/20 0.46
CA6 P23280 1/20 0.46
DPP4 P27487 1/20 0.46
CA5A P35218 1/20 0.46

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
SCHEMBL2449262 1.00 POLB (0.53) POLBTHRBATMTBXAS1MEN1
SCHEMBL10766999 0.89 F3 (0.51) TYRPPARAGSK3BBACE1
SCHEMBL11686354 0.89 THRB (0.65) POLBTHRBATMTBXAS1MEN1
SCHEMBL23424183 0.86 POLB (0.54) POLBTHRBATMTBXAS1MEN1
SCHEMBL28310063 0.84 THRB (0.65) POLBTHRBATMTBXAS1MEN1
SCHEMBL11684594 0.84 THRB (0.62) POLBTHRBATMTBXAS1HCAR2
SCHEMBL2449697 0.84 ALDH1A1 (0.57) POLBPKMPPARAALDH1A1L3MBTL1
SCHEMBL4064477 0.83 ALDH1A1 (0.56) POLBTHRBATMTBXAS1MEN1
Maleic Acid SCHEMBL9490054 0.83 THRB (0.57) THRBMEN1KMT2APKMALDH1A1
SCHEMBL7609794 0.82 THRB (0.66) POLBTHRBATMTBXAS1MEN1

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-1422255-B1 MAIN CHAIN TYPE LIQUID CRYSTAL POLYESTER LIQUID CRYSTALLINE COMPOSITION METHOD FOR PRODUCING LIQUID CRYSTAL FILM OPTICAL FILM AND DISPLAY NIPPON OIL CORP (JP) 2011-09-28 EP disclosed
US-20100208182-A1 METHOD FOR MANUFACTURING OPTICAL FILM NIPPON OIL CORPORATION (JP) 2010-08-19 US disclosed
EP-2202546-A1 METHOD FOR PRODUCING OPTICAL FILM Nippon Oil Corporation (JP) 2010-06-30 EP disclosed
US-6894141-B2 Main chain type liquid crystalline polyester, liquid crystalline composition, method for producing liquid crystal film and optical film, and display having optical film NIPPON OIL CORPORATION (JP) 2005-05-17 US disclosed
US-20040171788-A1 Main chain type liquid crystal polyester, liquid crystalline composition, method for producing liquid crystal film, optical film and display NOBLE VENTURE FINANCE I LIMITED (GB) 2004-09-02 US disclosed
EP-1422255-A1 MAIN CHAIN TYPE LIQUID CRYSTAL POLYESTER LIQUID CRYSTALLINE COMPOSITION METHOD FOR PRODUCING LIQUID CRYSTAL FILM OPTICAL FILM AND DISPLAY Nippon Oil Corporation (JP) 2004-05-26 EP disclosed