SCHEMBL16709779

SCHEMBL16709779

C=CC(=O)OCc1ccc(Sc2ccc3ccccc3c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.42
MAPT P10636 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
EGFR P00533 1/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
PKM P14618 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42
JAK1 P23458 1/20 0.42
MAPK1 P28482 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HCAR2 Q8TDS4 1/20 0.41
TGM2 P21980 2/20 0.40

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
SCHEMBL16709762 0.87 HCAR2 (0.45) THRBALDH1A1HCAR2TGM2TOP2A
SCHEMBL21577435 0.87 HCAR2 (0.50) THRBALDH1A1HPGDMAPK1KMT2A
SCHEMBL30715271 0.87 TGM2 (0.49) THRBMAPTKDM4EMEN1ALDH1A1
SCHEMBL845505 0.87 TGM2 (0.49) THRBMAPTKDM4EMEN1ALDH1A1
SCHEMBL16709780 0.87 HCAR2 (0.50) THRBALDH1A1HPGDMAPK1KMT2A
SCHEMBL12268166 0.87 HCAR2 (0.43) THRBMEN1ALDH1A1TP53CYP3A4
SCHEMBL16709710 0.84 THRB (0.39) THRBMAPTKDM4EMEN1ALDH1A1
SCHEMBL16709782 0.84 THRB (0.39) THRBMAPTKDM4EMEN1ALDH1A1
SCHEMBL21143000 0.83 MMP2 (0.41) THRBMAPTKDM4EMEN1ALDH1A1
SCHEMBL15020010 0.82 THRB (0.46) THRBMAPTKDM4EMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10611869-B2 Curable composition and cured product AGC Inc. (JP) 2020-04-07 US claimed
US-20190218325-A1 CURABLE COMPOSITION AND CURED PRODUCT AGC Inc. (JP) 2019-07-18 US claimed
US-10611869-B2 Curable composition and cured product AGC Inc. (JP) 2020-04-07 US disclosed
US-20190218325-A1 CURABLE COMPOSITION AND CURED PRODUCT AGC Inc. (JP) 2019-07-18 US disclosed
US-20190218325-A1 CURABLE COMPOSITION AND CURED PRODUCT AGC Inc. (JP) 2019-07-18 US disclosed
WO-2018062196-A1 CURABLE COMPOSITION AND CURED PRODUCT 旭硝子株式会社 2018-04-05 WO disclosed
WO-2015068839-A1 POLYMERIZABLE COMPOUND, RESIN COMPOSITION USING SAME, CURED RESIN, AND OPTICAL MATERIAL 新日鉄住金化学株式会社 2015-05-14 WO disclosed