SCHEMBL4033347

SCHEMBL4033347

CC(C)(C)[SiH2]OC(C)(C)c1cccc(N)c1N

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CD44 P16070 1/20 0.36
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
PIK3CA P42336 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL4393687 0.85 CYP3A4 (0.35) CYP3A4TSHRPIK3CAALDH1A1
SCHEMBL5460684 0.84 CD44 (0.39) CD44CYP3A4TSHRPIK3CA
SCHEMBL5465268 0.83 ALDH1A1 (0.36) ALDH1A1
SCHEMBL5462581 0.83 IDO1 (0.32) ALDH1A1
SCHEMBL5465608 0.72 NOS3 (0.40)
SCHEMBL1431415 0.72 CYP3A4 (0.33) CYP3A4TSHRPIK3CA
SCHEMBL8512559 0.72 CD44 (0.48) CD44CYP3A4TSHRPIK3CAALDH1A1
SCHEMBL6028201 0.72 CD44 (0.48) CD44CYP3A4TSHRPIK3CAALDH1A1
SCHEMBL106624 0.70 LPL (0.31)
SCHEMBL1922650 0.69 KDM4E (0.33) CYP3A4TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7541367-B2 3-benzoimidazolyl-pyrazolopyridines useful in treating kinase disorders JANSSEN PHARMACEUTICA, N.V. (BE) 2009-06-02 US disclosed
US-20090048249-A1 3-benzoimidazolyl-pyrazolopyridines useful in treating kinase disorders JANSSEN PHARMACEUTICA, N.V. (BE) 2009-02-19 US disclosed
WO-2006130673-A1 3-BENZOIMIDAZOLYL-PYRAZOLOPYRIDINES USEFUL IN TREATING KINASE DISORDERS JANSSEN PHARMACEUTICA, N.V. (BE) 2006-12-07 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-20090048249-A1 3-benzoimidazolyl-pyrazolopyridines useful in treating kinase disorders PRKDC, PRKACA, ABL1 CD44 4815/4885CYP3A4 3719/4885TSHR 2290/4885

“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.