SCHEMBL2298500

SCHEMBL2298500

CC(C)c1cc(Cc2c(NC3(C(C)C)C=CNN3)nc(N)nc2OC2CCCN(C)C2)on1

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 8/20 0.44
SLC5A7 Q9GZV3 6/20 0.41

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
SCHEMBL1792505 0.81 IGF1R (0.62) IGF1RSLC5A7
SCHEMBL4463976 0.77 IGF1R (0.45) IGF1RSLC5A7
SCHEMBL1792954 0.77 IGF1R (0.47) IGF1RSLC5A7
SCHEMBL1792577 0.73 IGF1R (0.46) IGF1RSLC5A7
SCHEMBL4463994 0.64 IGF1R (0.31) IGF1R
SCHEMBL1795880 0.63 IGF1R (0.66) IGF1R
SCHEMBL1788923 0.62 IGF1R (0.47) IGF1RSLC5A7
SCHEMBL11346470 0.61 IGF1R (1.00) IGF1R
SCHEMBL4457078 0.59 IGF1R (0.41) IGF1R
SCHEMBL1790427 0.59 ALDH1A1 (0.36) IGF1R

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-7999006-B2 Anticancer agents; mitogen-activated protein kinases (MEK) EXELIXIS, INC. (US) 2011-08-16 US disclosed
US-20080166359-A1 Methods of using MEK inhibitors EXELIXIS, INC. 2008-07-10 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-20080166359-A1 Methods of using MEK inhibitors BRAF, NRAS, KRAS IGF1R 2279/4885SLC5A7 1667/4885

“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.