SCHEMBL12972136

SCHEMBL12972136

CO[Si](C)(CCCNCc1ccc(CN)cc1)OC

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 5/20 0.45
KDM6B O15054 1/20 0.41
KDM4A O75164 1/20 0.41
KDM2A Q9Y2K7 1/20 0.41
HRH4 Q9H3N8 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
SCN8A Q9UQD0 4/20 0.40
TPSAB1 Q15661 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 2/20 0.38
THRB P10828 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
POLB P06746 1/20 0.37
MAOA P21397 1/20 0.37
LOXL2 Q9Y4K0 1/20 0.37

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
SCHEMBL12190422 0.86 CHRM2 (0.50) CHRM2KDM6BKDM4AKDM2AHRH4
SCHEMBL2445101 0.84 MAOA (0.56) CHRM2SCN8ATDP1MAOA
SCHEMBL5160165 0.81 CHRM2 (0.56) CHRM2SCN8ATDP1MAOA
SCHEMBL2448325 0.81 CHRM2 (0.42) CHRM2HRH4HRH3SCN8ASMN1; SMN2
SCHEMBL15361045 0.79 MAOA (0.59) CHRM2SCN8ATDP1MAOA
SCHEMBL9481297 0.75 CHRM2 (0.51) CHRM2SCN8AKDM4ETHRBCYP1A2
SCHEMBL17715564 0.74 HRH4 (0.63) CHRM2HRH4HRH3SMN1; SMN2CYP1A2
SCHEMBL8961179 0.74 LOXL2 (0.40) HRH3CYP1A2LOXL2
SCHEMBL7871234 0.74
SCHEMBL12082968 0.74 MC4R (0.58) CHRM2KDM6BKDM4AKDM2AHRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100303748-A1 METHOD FOR LIGHTENING AND/OR COLORING HUMAN KERATIN FIBERS USING A COMPOSITION COMPRISING AN AMINOTRIALKOXY SILANE OR AMINOTRIALKENYLOXY SILANE COMPOUND AND DEVICE L'OREAL S.A. (FR) 2010-12-02 US 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-20100303748-A1 METHOD FOR LIGHTENING AND/OR COLORING HUMAN KERATIN FIBERS USING A COMPOSITION COMPRISING AN AMINOTRIALKOXY SILANE OR AMINOTRIALKENYLOXY SILANE COMPOUND AND DEVICE KRT18, FABP4, APMAP CHRM2 1231/4885KDM6B 1099/4885KDM4A 1399/4885

“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.