SCHEMBL25001623

SCHEMBL25001623

COc1cc(N2CCOCC2)c(-c2cnn(C)c2)cc1Nc1ncc(Br)c(Nc2ccc3c(c2P(C)(C)=O)CC3)n1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 19/20 0.64
▸ BTK Q06187 2/20 0.64
▸ MAP4K1 Q92918 1/20 0.48
▸ CHEK1 O14757 1/20 0.48
▸ AURKA O14965 1/20 0.48
▸ CCNT1 O60563 1/20 0.48
▸ JAK2 O60674 1/20 0.48
▸ RET P07949 1/20 0.48
▸ MET P08581 1/20 0.48
▸ ROS1 P08922 1/20 0.48
▸ PDGFRB P09619 1/20 0.48
▸ KIT P10721 1/20 0.48
▸ PIM1 P11309 1/20 0.48
▸ PDGFRA P16234 1/20 0.48
▸ FER P16591 1/20 0.48
▸ EPHA1 P21709 1/20 0.48
▸ MAPK3 P27361 1/20 0.48
▸ EPHB2 P29323 1/20 0.48
▸ AXL P30530 1/20 0.48
▸ MAPK8 P45983 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
SCHEMBL25001789 0.89 EGFR (0.69) EGFRBTKMAP4K1
SCHEMBL25001626 0.89 EGFR (0.56) EGFRBTKMAP4K1JAK2
SCHEMBL22950947 0.87 EGFR (0.64) EGFRBTK
SCHEMBL25001948 0.87 EGFR (0.64) EGFRBTK
SCHEMBL25001794 0.86 EGFR (0.84) EGFRBTKMAP4K1
SCHEMBL25825143 0.85 EGFR (0.59) EGFRBTKCHEK1AURKACCNT1
SCHEMBL23420454 0.85 EGFR (0.67) EGFRBTKMAP4K1
SCHEMBL25001525 0.84 EGFR (0.62) EGFRBTK
SCHEMBL25001345 0.83 EGFR (0.61) EGFRBTK
SCHEMBL25001983 0.83 EGFR (0.57) EGFRBTKMAP4K1

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-20230219986-A1 NOVEL AMINOPYRIMIDINE EGFR INHIBITOR QILU PHARMACEUTICAL CO., LTD. (CN) 2023-07-13 — — US disclosed
US-20230219986-A1 NOVEL AMINOPYRIMIDINE EGFR INHIBITOR QILU PHARMACEUTICAL CO., LTD. (CN) 2023-07-13 — — US disclosed
EP-4129996-A1 NOVEL AMINOPYRIMIDINE EGFR INHIBITOR QILU PHARMACEUTICAL CO., LTD. (CN) 2023-02-08 — — EP 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-20230219986-A1 NOVEL AMINOPYRIMIDINE EGFR INHIBITOR EGFR, ERBB2, ERBB4 EGFR 1/4885BTK 265/4885MAP4K1 318/4885

“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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