SCHEMBL353052

SCHEMBL353052

C=CCOCOC(=O)C(=C)CC(CC)CCCC

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.46
CYP3A4 P08684 4/20 0.38
TDP1 Q9NUW8 3/20 0.38
ATM Q13315 1/20 0.38
RECQL P46063 1/20 0.36
CA2 P00918 4/20 0.35
ALDH1A1 P00352 6/20 0.35
CA1 P00915 1/20 0.33
LMNA P02545 3/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
MMP14 P50281 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MAPK1 P28482 3/20 0.32
HSD17B10 Q99714 1/20 0.32
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31

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
SCHEMBL1423548 0.89 TSHR (0.50) TSHRCYP3A4TDP1ATMRECQL
SCHEMBL25435343 0.82 TSHR (0.42) TSHRTDP1ALDH1A1
SCHEMBL16412765 0.80 TSHR (0.47) TSHRCYP3A4TDP1ATMRECQL
SCHEMBL1759450 0.80 TSHR (0.47) TSHRCYP3A4TDP1ATMRECQL
SCHEMBL353053 0.79 TSHR (0.56) TSHRCYP3A4TDP1ATMRECQL
SCHEMBL5013183 0.79 TSHR (0.58) TSHRCYP3A4TDP1ATMRECQL
SCHEMBL352760 0.79 TSHR (0.46) TSHRTDP1ATMALDH1A1
SCHEMBL27497374 0.79 TSHR (0.46) TSHRCYP3A4TDP1ATMRECQL
SCHEMBL4883991 0.77 TSHR (0.49) TSHRCYP3A4TDP1ATMRECQL
SCHEMBL351663 0.77 TSHR (0.53) TSHR

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
WO-2023162889-A1 POLYMER AND PHOTOSENSITIVE RESIN COMPOSITION THEREOF 株式会社日本触媒 2023-08-31 WO disclosed
WO-2023127300-A1 NON-AQUEOUS SECONDARY BATTERY BINDER POLYMER, NON-AQUEOUS SECONDARY BATTERY BINDER COMPOSITION, AND NON-AQUEOUS SECONDARY BATTERY ELECTRODE 株式会社レゾナック 2023-07-06 WO disclosed
EP-2415751-B1 ALPHA-(UNSATURATED ALKOXYALKYL) ACRYLATE COMPOSITION AND PROCESS FOR PRODUCTION THEREOF NIPPON CATALYTIC CHEM IND (JP) 2014-11-26 EP disclosed
US-8796492-B2 α-(unsaturated alkoxyalkyl) acrylate composition and process for production thereof NIPPON SHOKUBAI CO., LTD. (JP) 2014-08-05 US disclosed
EP-2415751-A1 ALPHA-(UNSATURATED ALKOXYALKYL) ACRYLATE COMPOSITION AND PROCESS FOR PRODUCTION THEREOF Nippon Shokubai Co., Ltd. (JP) 2012-02-08 EP disclosed
US-20120016095-A1 a-(UNSATURATED ALKOXYALKYL) ACRYLATE COMPOSITION AND PROCESS FOR PRODUCTION THEREOF NIPPON SHOKUBAI CO., LTD. (JP) 2012-01-19 US disclosed