SCHEMBL25215929

SCHEMBL25215929

O=[N+]([O-])c1cc2c(Nc3ccnc(-c4ccccc4F)c3)ncnc2cc1OCCCN1CCNCC1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 17/20 0.53
▸ ERBB2 P04626 3/20 0.47
▸ AURKA O14965 2/20 0.47
▸ PDGFRB P09619 2/20 0.47
▸ TEK Q02763 2/20 0.47
▸ AURKB Q96GD4 2/20 0.47
▸ FLT4 P35916 1/20 0.47
▸ KDR P35968 1/20 0.47
▸ RET P07949 2/20 0.47
▸ KIF5B P33176 2/20 0.47
▸ FBP1 P09467 1/20 0.45

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
SCHEMBL26055501 0.92 EGFR (0.51) EGFRERBB2AURKAPDGFRBTEK
SCHEMBL25220782 0.90 EGFR (0.49) EGFRERBB2AURKAPDGFRBTEK
SCHEMBL25663596 0.89 EGFR (0.47) EGFRERBB2AURKAPDGFRBTEK
SCHEMBL25246042 0.86 EGFR (0.48) EGFRERBB2AURKAPDGFRBTEK
SCHEMBL25215331 0.84 EPHA2 (0.45) EGFRERBB2AURKAPDGFRBTEK
SCHEMBL7002698 0.84 EGFR (0.74) EGFRERBB2FLT4KDRRET
SCHEMBL28969396 0.83 EGFR (0.46) EGFRERBB2AURKAPDGFRBTEK
SCHEMBL1418195 0.82 FBP1 (0.67) EGFRERBB2FBP1
SCHEMBL7003865 0.81 EGFR (0.70) EGFRERBB2FLT4KDRRET
SCHEMBL25258613 0.80 EGFR (0.44) EGFRERBB2KDRFBP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230271936-A1 EFGR INHIBITOR, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF ABBISKO THERAPEUTICS CO., LTD. (CN) 2023-08-31 — — US disclosed
US-20230271936-A1 EFGR INHIBITOR, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF ABBISKO THERAPEUTICS CO., LTD. (CN) 2023-08-31 — — US disclosed
US-20230271936-A1 EFGR INHIBITOR, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF ABBISKO THERAPEUTICS CO., LTD. (CN) 2023-08-31 — — US disclosed
EP-4194443-A1 EFGR INHIBITOR, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF Abbisko Therapeutics Co., Ltd. (CN) 2023-06-14 — — EP disclosed
CN-115803325-A EGFR inhibitor and preparation method and application thereof 上海和誉生物医药科技有限公司 2023-03-14 — — CN disclosed
WO-2022033410-A1 EFGR INHIBITOR, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 上海和誉生物医药科技有限公司 2022-02-17 — — WO 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-20230271936-A1 EFGR INHIBITOR, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF EGFR, WEE1, WEE2 EGFR 1/4885ERBB2 5/4885AURKA 2179/4885

“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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