SCHEMBL16265706

SCHEMBL16265706

CCC(C)[Si](C(C)CC)(C(C)CC)N1CCCN(CC(C)C(=O)OC)C1

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.31
CHRM2 P08172 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
CHRM3 P20309 1/20 0.31
DRD3 P35462 1/20 0.31
OPRD1 P41143 1/20 0.31
KCNH2 Q12809 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
PADI1 Q9ULC6 1/20 0.30
PADI4 Q9UM07 1/20 0.30

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
SCHEMBL16265691 0.92 CYP2D6 (0.31) CYP2D6
SCHEMBL16265628 0.90 CYP3A4 (0.35) CYP2D6CHRM2ADRA2BADRA2CCHRM3
SCHEMBL16265765 0.88 PADI1 (0.32) CYP2D6CHRM2ADRA2BADRA2CCHRM3
SCHEMBL16265632 0.84 CHRM2 (0.32) CYP2D6CHRM2ADRA2BADRA2CCHRM3
SCHEMBL16265541 0.83 ALDH1A1 (0.33) CYP2D6CHRM2ADRA2BADRA2CCHRM3
SCHEMBL16265669 0.83 CYP2D6 (0.35) CYP2D6CHRM2ADRA2BADRA2CCHRM3
SCHEMBL16265992 0.81 CYP3A4 (0.36)
SCHEMBL16265984 0.80 POLB (0.31) CYP2D6CHRM2ADRA2BDRD3SIGMAR1
SCHEMBL16265557 0.79 BCHE (0.34)
SCHEMBL16265912 0.79 BCHE (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2808329-B1 Silyl-Protected Nitrogen-Containing Cyclic Compounds and their method of preparation SHINETSU CHEMICAL CO (JP) 2018-09-26 EP disclosed
US-9233988-B2 Silyl-protected nitrogen-containing cyclic compounds and making method SHIN-ETSU CHEMICAL CO., LTD. (JP) 2016-01-12 US disclosed
CN-104211725-A Silyl-protected nitrogen-containing cyclic compounds and making method SHINETSU CHEMICAL CO 2014-12-17 CN disclosed
US-20140357862-A1 SILYL-PROTECTED NITROGEN-CONTAINING CYCLIC COMPOUNDS AND MAKING METHOD SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-12-04 US disclosed
EP-2808329-A1 Silyl-Protected Nitrogen-Containing Cyclic Compounds and Making Method Shin-Etsu Chemical Co., Ltd. (JP) 2014-12-03 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140357862-A1 SILYL-PROTECTED NITROGEN-CONTAINING CYCLIC COMPOUNDS AND MAKING METHOD PRMT9, CCNO, IPO9 CYP2D6 4195/4885CHRM2 1134/4885ADRA2B 3521/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.