SCHEMBL4151705

SCHEMBL4151705

CC(C)(C)[Si](OCc1cocn1)(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMYD2 Q9NRG4 2/20 0.33
CYP3A4 P08684 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
GRM5 P41594 1/20 0.31
GRM1 Q13255 1/20 0.31
TACR1 P25103 1/20 0.31

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
SCHEMBL1314001 0.75 AGXT (0.42) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL30688992 0.74 SMYD2 (0.36) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL3879562 0.73 SMYD2 (0.33) SMYD2CYP3A4HTTSMN1; SMN2GRM5
SCHEMBL16665017 0.73 SLC6A3 (0.38) SMYD2CYP3A4HTTSMN1; SMN2GRM5
SCHEMBL29623921 0.73 GABRA1 (0.38) SMYD2CYP3A4HTTSMN1; SMN2GRM5
SCHEMBL4150467 0.73 SMYD2 (0.35) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL2914346 0.72 SMYD2 (0.36) SMYD2CYP3A4HTTSMN1; SMN2GRM5
SCHEMBL28556711 0.72 SMYD2 (0.37) SMYD2CYP3A4HTTSMN1; SMN2GRM5
SCHEMBL3598198 0.72 ALOX5AP (0.41) SMYD2CYP3A4HTTSMN1; SMN2GRM5
SCHEMBL1181594 0.72 ATM (0.35) CYP3A4HTTSMN1; SMN2GRM5GRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090170907-A1 Chemical Compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-07-02 US disclosed
US-20090170907-A1 Chemical Compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-07-02 US disclosed
EP-1888512-A2 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2008-02-20 EP disclosed
WO-2006133216-A2 4-SUBSTITUTED ARYLAMINE DERIVATIVES AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS SMITHKLINE BEECHAM CORPORATION (US) 2006-12-14 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 (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-20090170907-A1 Chemical Compounds NR3C2, NR5A1, NR3C1 SMYD2 3493/4885CYP3A4 211/4885HTT 4348/4885

“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.