SCHEMBL6906012

SCHEMBL6906012

C[Si](C)(C)CCOCn1ccnc1C=CC(=O)c1ccc(C#N)cc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P4HB P07237 5/20 0.40
MAPT P10636 4/20 0.38
ALDH1A1 P00352 3/20 0.38
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GAA P10253 1/20 0.37
DGAT1 O75907 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
KEAP1 Q14145 3/20 0.33
NFE2L2 Q16236 3/20 0.33
MYC P01106 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.32

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
SCHEMBL6906011 1.00 P4HB (0.40) P4HBMAPTALDH1A1LMNAL3MBTL1
SCHEMBL6905906 0.80 LMNA (0.32) ALDH1A1LMNADGAT1
SCHEMBL6905912 0.80 LMNA (0.32) ALDH1A1LMNADGAT1
SCHEMBL3939670 0.79 TBXAS1 (0.34) MAPTDGAT1
SCHEMBL7500213 0.79 PTPN1 (0.38) P4HBMAPTGAAKEAP1NFE2L2
SCHEMBL6905827 0.76 GAA (0.41) MAPTALDH1A1GAADGAT1MYC
SCHEMBL7499463 0.74 MAPT (0.37) MAPTALDH1A1SMN1; SMN2
SCHEMBL5098905 0.73 P4HB (0.47) P4HBMAPTALDH1A1LMNAL3MBTL1
SCHEMBL1767760 0.71 DGAT1 (0.35) DGAT1
SCHEMBL3070906 0.70 DGAT1 (0.36) DGAT1

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-20040110764-A1 Inhibitors of prenyl-protein transferase STUMP CRAIG A (US) 2004-06-10 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-20040110764-A1 Inhibitors of prenyl-protein transferase FNTA, KRAS, PTAR1 P4HB 1536/4885MAPT 2884/4885ALDH1A1 3634/4885

“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.