SCHEMBL9504513

SCHEMBL9504513

CCCCN(CC)CCCC.CO[SiH](OC)OC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 9/20 0.39
KDM5A P29375 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
HTR1D P28221 1/20 0.38
HTR1B P28222 1/20 0.38
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA9 Q16790 2/20 0.35
PLA2G1B P04054 1/20 0.34
PLA2G2A P14555 1/20 0.34
CHRM2 P08172 1/20 0.34
HTR1A P08908 1/20 0.34
ADRA2A P08913 1/20 0.34
CHRM1 P11229 1/20 0.34
DRD1 P21728 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
ADRA1A P35348 1/20 0.34
OPRM1 P35372 1/20 0.34
DRD3 P35462 1/20 0.34

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
SCHEMBL4264239 0.84 KCNH2 (0.31) KCNH2
SCHEMBL217114 0.84 KCNH2 (0.47) KCNH2KDM5AKDM4CHTR1DHTR1B
Hydrochloric Acid SCHEMBL22771631 0.81 KCNH2 (0.45) KCNH2KDM5AKDM4CHTR1DHTR1B
SCHEMBL6700326 0.81
SCHEMBL5891723 0.79 MEN1 (0.33) KCNH2
Chloromethane SCHEMBL27830649 0.78 KCNH2 (0.48) KCNH2KDM5AKDM4CHTR1DHTR1B
SCHEMBL516414 0.78 KCNH2 (0.52) KCNH2KDM5AKDM4CCA12CA1
SCHEMBL16137203 0.78 KCNH2 (0.44) KCNH2KDM5AKDM4CHTR1DHTR1B
SCHEMBL218868 0.78 KCNH2 (0.44) KCNH2KDM5AKDM4CHTR1DHTR1B
SCHEMBL12484771 0.78 HTR1B (0.44) KCNH2KDM5AKDM4CHTR1DHTR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0365982-B1 ACRYLIC RUBBER COMPOSITION TORAY SILICONE COMPANY, LIMITED (JP) 1993-07-14 EP disclosed
US-5002995-A Roll workability, rapid vulcanization rate TORAY SILICONE COMPANY, LIMITED (JP) 1991-03-26 US disclosed
EP-0365982-A1 Acrylic rubber composition TORAY SILICONE COMPANY, LIMITED (JP) 1990-05-02 EP disclosed