SCHEMBL14240767

SCHEMBL14240767

Cc1cnc(Cl)nc1Nc1ccccc1P(C)(C)=O

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CDK7 P50613 1/20 0.48
▸ CDK9 P50750 1/20 0.48
▸ ALK Q9UM73 4/20 0.47
▸ INSR P06213 3/20 0.47
▸ IGF1R P08069 3/20 0.47
▸ PTK2 Q05397 9/20 0.43
▸ MAP4K1 Q92918 3/20 0.43
▸ EGFR P00533 2/20 0.42

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
SCHEMBL30503695 1.00 CDK7 (0.48) CDK7CDK9ALKINSRIGF1R
SCHEMBL29400320 0.88 CDK7 (0.60) CDK7CDK9ALKINSRIGF1R
SCHEMBL11916362 0.88 CDK7 (0.60) CDK7CDK9ALKINSRIGF1R
SCHEMBL22788897 0.86 CDK7 (0.45) CDK7CDK9ALKINSRIGF1R
SCHEMBL30173407 0.85 IGF1R (0.49) CDK7CDK9ALKINSRIGF1R
SCHEMBL22246100 0.85 MAP4K1 (0.48) CDK7CDK9ALKINSRIGF1R
SCHEMBL13832181 0.85 IGF1R (0.49) CDK7CDK9ALKINSRIGF1R
SCHEMBL23154179 0.84 ALK (0.40) CDK7CDK9ALKINSRIGF1R
SCHEMBL24179108 0.84 ALK (0.39) CDK7CDK9ALKINSRIGF1R
SCHEMBL28587033 0.84 CDK7 (0.47) CDK7CDK9ALKINSRIGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113677680-B EGFR inhibitor, composition and application thereof 贝达药业股份有限公司 2024-05-10 — — CN disclosed
CN-113302196-B EGFR inhibitor, composition and application thereof 贝达药业股份有限公司 2023-08-04 — — CN disclosed
US-20230192734-A1 TRICYCLIC COMPOUNDS AS EGFR INHIBITORS QILU PHARMACEUTICAL CO LTD (CN) 2023-06-22 — — US disclosed
US-20230192734-A1 TRICYCLIC COMPOUNDS AS EGFR INHIBITORS QILU PHARMACEUTICAL CO LTD (CN) 2023-06-22 — — US disclosed
EP-4137484-A1 TRICYCLIC COMPOUNDS AS EGFR INHIBITORS QILU PHARMACEUTICAL CO., LTD. (CN) 2023-02-22 — — EP disclosed
CN-113677680-A EGFR inhibitor and composition and application thereof 贝达药业股份有限公司 2021-11-19 — — CN disclosed
CN-113302196-A EGFR inhibitor and composition and application thereof 贝达药业股份有限公司 2021-08-24 — — CN disclosed
WO-2020200191-A1 EGFR INHIBITORS, COMPOSITIONS AND METHODS THERE OF BETTA PHARMACEUTICALS CO., LTD (CN) 2020-10-08 — — WO disclosed
WO-2020147702-A1 EGFR INHIBITORS, COMPOSITIONS AND METHODS THEREOF BETTA PHARMACEUTICALS CO., LTD (CN) 2020-07-23 — — WO disclosed
US-20120316135-A1 Compounds for Inhibiting Cell Proliferation in EGFR-Driven Cancers ARIAD PHARMACEUTICALS, INC. (US) 2012-12-13 — — 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 (2 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-20120316135-A1 Compounds for Inhibiting Cell Proliferation in EGFR-Driven Cancers EGFR, MKI67, ERBB2 CDK7 56/4885CDK9 36/4885ALK 293/4885
US-20230192734-A1 TRICYCLIC COMPOUNDS AS EGFR INHIBITORS EGFR, ERBB2, ERBB3 CDK7 52/4885CDK9 39/4885ALK 82/4885

“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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