SCHEMBL17816428

SCHEMBL17816428

CN(C)C[Si](C)(C)COc1ccc(C=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
LMNA P02545 2/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
CYP2A6 P11509 2/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 5/20 0.42
ALDH1A3 P47895 2/20 0.40
CYP2A13 Q16696 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
RAB9A P51151 1/20 0.38
ALDH3A1 P30838 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
SCHEMBL16429677 0.81 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2LMNAMAPTHPGD
SCHEMBL4964458 0.79 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2LMNAMAPTHPGD
SCHEMBL16415681 0.77 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2LMNAMAPTHPGD
SCHEMBL8995211 0.75 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2LMNAMAPTHPGD
SCHEMBL272824 0.75 ALDH1A1 (0.62) ALDH1A1SMN1; SMN2LMNAMAPTHPGD
Hydrochloric Acid SCHEMBL5693237 0.73 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2LMNAMAPTHPGD
SCHEMBL11734984 0.73 ALDH1A1 (0.64) ALDH1A1SMN1; SMN2LMNAMAPTHPGD
SCHEMBL6386806 0.73 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2LMNAMAPTHPGD
SCHEMBL209831 0.73 HRH3 (0.58) ALDH1A1SMN1; SMN2LMNAMAPTHPGD
Hydrochloric Acid SCHEMBL5692377 0.71 HRH3 (0.56) ALDH1A1SMN1; SMN2LMNAMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9828393-B2 Silylalkyloxyaryl compounds and methods for treating cancer THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2017-11-28 US disclosed
US-20160159832-A1 SILYLALKYLOXYARYL COMPOUNDS AND METHODS FOR TREATING CANCER THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE 2016-06-09 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-20160159832-A1 SILYLALKYLOXYARYL COMPOUNDS AND METHODS FOR TREATING CANCER BCL3, MYLK2, BCL2L13 ALDH1A1 1626/4885SMN1; SMN2 24/4885LMNA 119/4885

“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.