SCHEMBL22028766

SCHEMBL22028766

COc1cc(C2CCNCC2)ccc1Nc1cc(Nc2ccccc2NS(C)(=O)=O)c(C)cn1

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 14/20 0.73
▸ MET P08581 1/20 0.65
▸ ALK Q9UM73 6/20 0.51
▸ NPM1 P06748 1/20 0.48

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
SCHEMBL21846976 0.84 EGFR (1.00) EGFRMETALK
SCHEMBL21846967 0.82 EGFR (1.00) EGFRMETALK
SCHEMBL21846975 0.81 EGFR (1.00) EGFRMETALK
SCHEMBL21846990 0.79 EGFR (1.00) EGFRMETALK
SCHEMBL21847020 0.79 EGFR (1.00) EGFRMETALK
SCHEMBL21847025 0.77 EGFR (1.00) EGFRMETALK
SCHEMBL22028768 0.73 EGFR (0.56) EGFRMETALKNPM1
SCHEMBL22028767 0.73 EGFR (0.56) EGFRMETALKNPM1
SCHEMBL1545887 0.72 ALK (0.51) EGFRMETALKNPM1
SCHEMBL21847011 0.71 EGFR (1.00) EGFRMETALK

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-20200179384-A1 N2,N4-DIPHENYLPYRIMIDINE-2,4-DIAMINE DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR PREVENTION OR TREATMENT OF CANCER KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2020-06-11 — — US claimed

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-20200179384-A1 N2,N4-DIPHENYLPYRIMIDINE-2,4-DIAMINE DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR PREVENTION OR TREATMENT OF CANCER FLT3, EGFR, ERBB2 EGFR 2/4885MET 169/4885ALK 76/4885

“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.

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