SCHEMBL3707057

SCHEMBL3707057

CC#CC(=O)c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 17/20 0.75
▸ ERBB2 P04626 16/20 0.75
▸ ERBB4 Q15303 4/20 0.71
▸ GAK O14976 1/20 0.67
▸ ABL1 P00519 4/20 0.64
▸ INSR P06213 4/20 0.64
▸ PDGFRB P09619 4/20 0.64
▸ CDK2 P24941 4/20 0.64
▸ PLK1 P53350 4/20 0.64
▸ HDAC1 Q13547 4/20 0.64
▸ HDAC8 Q9BY41 4/20 0.64
▸ HDAC6 Q9UBN7 4/20 0.64
▸ HDAC3 O15379 3/20 0.64
▸ HDAC4 P56524 3/20 0.64
▸ HDAC7 Q8WUI4 3/20 0.64
▸ HDAC2 Q92769 3/20 0.64
▸ HDAC10 Q969S8 3/20 0.64
▸ HDAC11 Q96DB2 3/20 0.64
▸ HDAC9 Q9UKV0 3/20 0.64
▸ HDAC5 Q9UQL6 3/20 0.64

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
SCHEMBL29651928 1.00 EGFR (0.75) EGFRERBB2ERBB4GAKABL1
SCHEMBL12225357 0.91 EGFR (0.61) EGFRERBB2ERBB4GAKABL1
SCHEMBL6954796 0.91 EGFR (0.84) EGFRERBB2ERBB4GAKABL1
SCHEMBL6959487 0.91 EGFR (0.66) EGFRERBB2ERBB4GAKABL1
SCHEMBL3702763 0.90 EGFR (0.77) EGFRERBB2ERBB4GAKABL1
SCHEMBL19121111 0.90 EGFR (0.67) EGFRERBB2ERBB4GAKABL1
SCHEMBL23127803 0.88 ERBB2 (0.65) EGFRERBB2ERBB4GAKABL1
SCHEMBL20436802 0.88 EGFR (0.65) EGFRERBB2ERBB4GAKABL1
SCHEMBL20220592 0.88 ERBB2 (0.65) EGFRERBB2ERBB4GAKABL1
SCHEMBL6960054 0.88 EGFR (0.65) EGFRERBB2ERBB4GAKABL1

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3574906-B1 SOLID PREPARATION COMPRISING QUINAZOLINE DERIVATIVE SHIONOGI & CO (JP) 2024-07-03 — — EP disclosed
EP-3330267-B1 SALT OF QUINAZOLINE DERIVATIVE OR CRYSTAL THEREOF, AND METHOD FOR PRODUCING SALT OF QUINAZOLINE DERIVATIVE OR CRYSTAL THEREOF SHIONOGI & CO (JP) 2022-01-05 — — EP disclosed
US-10953016-B2 Solid dosage form containing quinazoline derivative SHIONOGI & CO., LTD. (JP) 2021-03-23 — — US disclosed
US-20190256506-A1 SALTS OF QUINAZOLINE DERIVATIVE OR CRYSTALS THEREOF, AND THE PROCESS FOR PRODUCING THEREOF SHIONOGI & CO., LTD. (JP) 2019-08-22 — — US disclosed
US-10329285-B2 Salts of quinazoline derivative or crystals thereof, and the process for producing thereof SHIONOGI & CO., LTD. (JP) 2019-06-25 — — US disclosed
US-20180215744-A1 SALTS OF QUINAZOLINE DERIVATIVE OR CRYSTALS THEREOF, AND THE PROCESS FOR PRODUCING THEREOF SHIONOGI & CO., LTD. (JP) 2018-08-02 — — US disclosed
US-20180215744-A1 SALTS OF QUINAZOLINE DERIVATIVE OR CRYSTALS THEREOF, AND THE PROCESS FOR PRODUCING THEREOF SHIONOGI & CO., LTD. (JP) 2018-08-02 — — US disclosed
EP-3330267-A1 SALT OF QUINAZOLINE DERIVATIVE OR CRYSTAL THEREOF, AND METHOD FOR PRODUCING SALT OF QUINAZOLINE DERIVATIVE OR CRYSTAL THEREOF Shionogi&Co., Ltd. (JP) 2018-06-06 — — EP disclosed
US-9951051-B2 Process for producing alkynylketone derivative SHIONOGI & CO., LTD. (JP) 2018-04-24 — — US disclosed
US-9951051-B2 Process for producing alkynylketone derivative SHIONOGI & CO., LTD. (JP) 2018-04-24 — — US disclosed
US-20120123114-A1 QUINAZOLINE DERIVATIVES HAVING TYROSINE KINASE INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2012-05-17 — — US disclosed
US-20120123114-A1 QUINAZOLINE DERIVATIVES HAVING TYROSINE KINASE INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2012-05-17 — — US disclosed
US-20110257391-A1 PROCESS FOR PRODUCTION OF QUINAZOLINE DERIVATIVE SHIONOGI & CO., LTD. (JP) 2011-10-20 — — US disclosed
US-20110257391-A1 PROCESS FOR PRODUCTION OF QUINAZOLINE DERIVATIVE SHIONOGI & CO., LTD. (JP) 2011-10-20 — — US disclosed
EP-2374801-A1 METHOD FOR PRODUCING QUINAZOLINE DERIVATIVE Shionogi&Co., Ltd. (JP) 2011-10-12 — — EP disclosed
US-20090143414-A1 Quinazoline Derivatives Having Tyrosine Kinase Inhibitory Activity SHIONOGI & CO., LTD. (JP) 2009-06-04 — — US disclosed
US-20090143414-A1 Quinazoline Derivatives Having Tyrosine Kinase Inhibitory Activity SHIONOGI & CO., LTD. (JP) 2009-06-04 — — US disclosed
US-20090143414-A1 Quinazoline Derivatives Having Tyrosine Kinase Inhibitory Activity SHIONOGI & CO., LTD. (JP) 2009-06-04 — — US disclosed
EP-1854789-A1 QUINAZOLINE DERIVATIVE HAVING TYROSINE KINASE INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2007-11-14 — — EP disclosed
EP-1854789-A1 QUINAZOLINE DERIVATIVE HAVING TYROSINE KINASE INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2007-11-14 — — 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 (7 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-10953016-B2 Solid dosage form containing quinazoline derivative RAB5C, MAP1LC3C, TBC1D5 EGFR 3987/4885ERBB2 3948/4885ERBB4 3894/4885
US-20180215744-A1 SALTS OF QUINAZOLINE DERIVATIVE OR CRYSTALS THEREOF, AND THE PROCESS FOR PRODUCING THEREOF NQO2, SQLE, CYP3A5 EGFR 3993/4885ERBB2 4104/4885ERBB4 3934/4885
US-20110257391-A1 PROCESS FOR PRODUCTION OF QUINAZOLINE DERIVATIVE ABL1, MAP2K5, MAP2K2 EGFR 213/4885ERBB2 42/4885ERBB4 86/4885
US-20090143414-A1 Quinazoline Derivatives Having Tyrosine Kinase Inhibitory Activity ERBB2, EGFR, ABL1 EGFR 2/4885ERBB2 1/4885ERBB4 5/4885
US-20190256506-A1 SALTS OF QUINAZOLINE DERIVATIVE OR CRYSTALS THEREOF, AND THE PROCESS FOR PRODUCING THEREOF NQO2, SQLE, CYP3A5 EGFR 3993/4885ERBB2 4104/4885ERBB4 3934/4885
US-20120123114-A1 QUINAZOLINE DERIVATIVES HAVING TYROSINE KINASE INHIBITORY ACTIVITY ERBB2, EGFR, ABL1 EGFR 2/4885ERBB2 1/4885ERBB4 5/4885
US-10329285-B2 Salts of quinazoline derivative or crystals thereof, and the process for producing thereof NQO2, SQLE, CYP3A5 EGFR 3993/4885ERBB2 4104/4885ERBB4 3934/4885

“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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