SCHEMBL7186486

SCHEMBL7186486

C=CC(=O)O[SiH2]c1cccc(C)c1C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.33
CYP3A4 P08684 2/20 0.33
LMNA P02545 2/20 0.33
PTGS2 P35354 2/20 0.33
MEN1 O00255 1/20 0.33
AKR1B10 O60218 1/20 0.33
ABCB11 O95342 1/20 0.33
DHFR P00374 1/20 0.33
MPO P05164 1/20 0.33
CYP1A2 P05177 1/20 0.33
CHRM1 P11229 1/20 0.33
CYP2C9 P11712 1/20 0.33
AKR1B1 P15121 1/20 0.33
PTGS1 P23219 1/20 0.33
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
KMT2A Q03164 1/20 0.33
AKR1C1 Q04828 1/20 0.33
HIF1A Q16665 1/20 0.33
NAPRT Q6XQN6 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
SCHEMBL707653 0.80 PTPN1 (0.41) TRPA1CYP3A4LMNAPTGS2MEN1
SCHEMBL10535392 0.78 TRPA1 (0.36) TRPA1CYP3A4LMNAPTGS2MEN1
SCHEMBL7184008 0.77 ALDH1A1 (0.35) TRPA1CYP3A4LMNAPTGS2MEN1
SCHEMBL5837886 0.73 TDP1 (0.37) CYP3A4CYP2C9TDP1ATMGAA
SCHEMBL21496261 0.73 LMNA (0.33) CYP3A4LMNACYP1A2PTGS1KMT2A
SCHEMBL10951743 0.73 LMNA (0.35) CYP3A4LMNAMEN1KMT2AATM
SCHEMBL27863594 0.72 MAPK1 (0.47) LMNAPTGS2MEN1CYP1A2CYP2C9
SCHEMBL4595586 0.71 POLB (0.51) CYP3A4LMNAMEN1CYP1A2CYP2C9
SCHEMBL5409861 0.70 TRPA1 (0.41) TRPA1CYP1A2TDP1ATMMAPT
SCHEMBL447683 0.70 TRPA1 (0.41) TRPA1CYP1A2TDP1ATMMAPT

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