SCHEMBL622918

SCHEMBL622918

CC(=O)[Si](C)(C(C)C)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TSHR P16473 1/20 0.32
LMNA P02545 1/20 0.31
TP53 P04637 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
SCHEMBL14760075 0.69 TSHR (0.33) ALDH1A1TDP1TSHRLMNATP53
SCHEMBL444840 0.65
SCHEMBL454373 0.62 LMNA (0.42) ALDH1A1TDP1TSHRLMNA
Acetone SCHEMBL22720597 0.62
Acetone SCHEMBL1379842 0.60
SCHEMBL28346313 0.60
Acetone SCHEMBL10855260 0.57 LMNA (0.60) ALDH1A1TDP1TSHRLMNATP53
Acetone SCHEMBL10768381 0.57 LMNA (0.60) ALDH1A1TDP1TSHRLMNATP53
SCHEMBL5051122 0.57 LMNA (0.46) ALDH1A1TDP1TSHRLMNATP53
SCHEMBL24113 0.57

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2421873-B1 ALPHA-SILYL ALCOHOLS POSSESSING OLFACTORY PROPERTIES REMINISCENT OF PATCHOULI OIL GIVAUDAN SA (CH) 2014-07-02 EP disclosed
US-8633304-B2 Oligonucleotide derivative comprising an aromatic compound GIFU UNIVERSITY (JP) 2014-01-21 US disclosed
US-20120245341-A1 AROMATIC COMPOUND, MODIFICATION CARRIER THAT USES SAME AND IS USED FOR SYNTHESIZING AN OLIGONUCLEOTIDE DERIVATIVE, OLIGONUCLEOTIDE DERIVATIVE, AND OLIGONUCLEOTIDE CONSTRUCT GIFU UNIVERSITY (JP) 2012-09-27 US disclosed
US-8182781-B2 Alpha-silyl alcohols possessing olfactory properties reminiscent of patchouli oil GIVAUDAN S.A. (CH) 2012-05-22 US disclosed
EP-2421873-A1 ALPHA-SILYL ALCOHOLS POSSESSING OLFACTORY PROPERTIES REMINISCENT OF PATCHOULI OIL Givaudan SA (CH) 2012-02-29 EP disclosed
US-20120040879-A1 Alpha-Silyl Alcohols Possessing Olfactory Properties Reminiscent Of Patchouli Oil GIVAUDAN SA (CH) 2012-02-16 US disclosed
WO-2010121979-A1 ALPHA-SILYL ALCOHOLS POSSESSING OLFACTORY PROPERTIES REMINISCENT OF PATCHOULI OIL GIVAUDAN SA (CH) 2010-10-28 WO 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 (2 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-20120245341-A1 AROMATIC COMPOUND, MODIFICATION CARRIER THAT USES SAME AND IS USED FOR SYNTHESIZING AN OLIGONUCLEOTIDE DERIVATIVE, OLIGONUCLEOTIDE DERIVATIVE, AND OLIGONUCLEOTIDE CONSTRUCT NSUN2, SLCO2A1, ABCB7 ALDH1A1 1265/4885TDP1 1422/4885TSHR 1329/4885
US-20120040879-A1 Alpha-Silyl Alcohols Possessing Olfactory Properties Reminiscent Of Patchouli Oil FOXK1, S1PR3, CHRM1 ALDH1A1 578/4885TDP1 4793/4885TSHR 4466/4885

“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.