SCHEMBL23944943

SCHEMBL23944943

COc1cc(NCCN(C)C)c([N+](=O)[O-])cc1Nc1ncc(Cl)c(-c2c3n(c4ccccc24)CCOC3)n1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 0.64
IGF1R P08069 7/20 0.40
KCNH2 Q12809 7/20 0.40
INSR P06213 1/20 0.38

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
SCHEMBL18239603 0.90 EGFR (0.74) EGFRIGF1RKCNH2INSR
SCHEMBL18239605 0.87 EGFR (0.59) EGFRIGF1RKCNH2INSR
SCHEMBL18202149 0.82 EGFR (0.64) EGFRIGF1RKCNH2
SCHEMBL18239598 0.81 EGFR (0.76) EGFRIGF1RKCNH2INSR
SCHEMBL18239606 0.81 EGFR (0.62) EGFRIGF1RKCNH2
SCHEMBL18202145 0.81 EGFR (0.51) EGFRIGF1RKCNH2
SCHEMBL18202150 0.80 EGFR (0.56) EGFRIGF1RKCNH2
SCHEMBL22510208 0.79 EGFR (0.60) EGFRIGF1RKCNH2
SCHEMBL18202334 0.78 EGFR (0.73) EGFRKCNH2INSR
SCHEMBL18229913 0.78 EGFR (1.00) EGFRIGF1RKCNH2INSR

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-20210323976-A1 HETEROARYL COMPOUNDS FOR KINASE INHIBITION ARIAD PHARMACEUTICALS, INC. 2021-10-21 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-20210323976-A1 HETEROARYL COMPOUNDS FOR KINASE INHIBITION ERBB2, EGFR, ERBB3 EGFR 2/4885IGF1R 384/4885KCNH2 4480/4885

“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.