SCHEMBL25001487

SCHEMBL25001487

COc1cc(N2CCOCC2)c(-c2cnn(C)c2)cc1Nc1ncc(Br)c(Nc2ccccc2NS(=O)(=O)C2CC2)n1

nearest known ligand 0.76

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 14/20 0.76
▸ BTK Q06187 1/20 0.64
▸ ULK1 O75385 2/20 0.53
▸ LRRK2 Q5S007 2/20 0.51
▸ GSK3A P49840 1/20 0.51
▸ MAPK15 Q8TD08 1/20 0.51
▸ CAMKK2 Q96RR4 1/20 0.51
▸ ALK Q9UM73 2/20 0.47
▸ CDK19 Q9BWU1 1/20 0.47
▸ ROS1 P08922 1/20 0.46
▸ ZAP70 P43403 1/20 0.46

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
SCHEMBL25001489 0.94 EGFR (0.84) EGFRBTKULK1LRRK2GSK3A
SCHEMBL27091391 0.90 EGFR (0.75) EGFRBTKLRRK2GSK3AMAPK15
SCHEMBL30748473 0.88 EGFR (0.68) EGFRBTKULK1ALK
SCHEMBL25001760 0.88 EGFR (0.68) EGFRBTKULK1ALK
SCHEMBL27091454 0.88 EGFR (0.74) EGFRBTKULK1LRRK2GSK3A
SCHEMBL25001952 0.88 EGFR (0.73) EGFRBTKULK1LRRK2GSK3A
SCHEMBL25002762 0.88 EGFR (0.65) EGFRBTKULK1LRRK2ALK
SCHEMBL25001951 0.87 EGFR (0.66) EGFRBTKULK1LRRK2ALK
SCHEMBL30140980 0.86 EGFR (0.66) EGFRBTKULK1LRRK2ALK
SCHEMBL23304015 0.86 EGFR (1.00) EGFRBTKLRRK2GSK3AMAPK15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112538072-B Aminopyrimidine EGFR inhibitors 齐鲁制药有限公司 2024-02-06 — — CN disclosed
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
CN-112538072-A Novel aminopyrimidine EGFR (epidermal growth factor receptor) inhibitor 齐鲁制药有限公司 2021-03-23 — — CN 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 265/4885ULK1 1059/4885

“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.

Send feedback