SCHEMBL7181771

SCHEMBL7181771

C=C(C)C(=O)O[SiH2]c1cccc(CCCC)c1CCCC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.36
PPARG P37231 2/20 0.36
BID P55957 3/20 0.35
MCL1 Q07820 3/20 0.35
BCL2L1 Q07817 2/20 0.35
BAK1 Q16611 2/20 0.35
KAT8 Q9H7Z6 2/20 0.35
EP300 Q09472 1/20 0.35
KAT2A Q92830 1/20 0.35
KAT2B Q92831 1/20 0.35
KAT5 Q92993 1/20 0.35
SAE1 Q9UBE0 1/20 0.35
THRA P10827 2/20 0.34
THRB P10828 2/20 0.34
TSHR P16473 2/20 0.34
CYSLTR2 Q9NS75 2/20 0.33
CYSLTR1 Q9Y271 2/20 0.33
ALOX5 P09917 1/20 0.33
PTGS2 P35354 1/20 0.33
LTB4R Q15722 1/20 0.33

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
SCHEMBL705554 0.87 PPARA (0.42) PPARAPPARGBIDMCL1BCL2L1
SCHEMBL7181789 0.82 THRB (0.48) PPARAPPARGBIDMCL1BCL2L1
SCHEMBL703233 0.75 LTB4R (0.36) PPARAPPARGLTB4RLTB4R2IAPP
SCHEMBL27512654 0.74 LIPG (0.41) PPARAPPARGBIDMCL1BCL2L1
SCHEMBL1851096 0.74 PPARA (0.55) PPARAPPARGBIDMCL1BCL2L1
SCHEMBL704395 0.74 PPARA (0.42) PPARAPPARGBIDMCL1BCL2L1
SCHEMBL3482554 0.73 CYP3A4 (0.41) PPARAPPARGBIDMCL1BCL2L1
SCHEMBL703006 0.72 PTGS2 (0.35) PPARAPPARGBIDMCL1BCL2L1
SCHEMBL707831 0.72 PTGS2 (0.35) PPARAPPARGBIDMCL1BCL2L1
SCHEMBL10436157 0.72 NCEH1 (0.38) PPARAPPARGTHRATHRBTSHR

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
US-6630079-B2 Bis(2- pyridinethiol-1-oxide) copper salt, does not exert any adverse influence on the storage stability or antifouling effect, and the effect of the salt does not change by the coating with an acrylic resin API CORPORATION (JP) 2003-10-07 US disclosed
EP-1080640-B1 COATED BIS(2-PYRIDINETHIOL-1-OXIDE)COPPER SALT API CORP (JP) 2003-09-10 EP disclosed
US-20030124085-A1 Coated bis (2-pyridinethiol-1-oxide) copper salt API CORPORATION (JP) 2003-07-03 US disclosed
US-6544440-B1 Antifouling active ingredient for a coating for the bottom of a ship, which is safe during handling; rosin coated; biocides API CORPORATION (JP) 2003-04-08 US disclosed
EP-1227111-A1 TRIPHENYLBORON-CONTAINING POLYMERS AND USE THEREOF Yoshitomi Fine Chemicals, Ltd. (JP) 2002-07-31 EP disclosed
EP-1080640-A1 COATED BIS(2-PYRIDINETHIOL 1-OXIDE) COPPER SALT Yoshitomi Fine Chemicals, Ltd. (JP) 2001-03-07 EP disclosed