Mubritinib

Mubritinib

SCHEMBL6758913

Cl.FC(F)(F)c1ccc(C=Cc2nc(COc3ccc(CCCCn4ccnn4)cc3)co2)cc1

nearest known ligand 0.98

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ERBB2

The experimentally established mechanism targets of Mubritinib. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ERBB2 known ✓ P04626 20/20 0.98
MINK1 Q8N4C8 1/20 0.98

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
Mubritinib SCHEMBL6758911 1.00 ERBB2 (0.98) ERBB2MINK1
Mubritinib SCHEMBL94943 0.99 ERBB2 (1.00) ERBB2MINK1
Mubritinib SCHEMBL571874 0.99 ERBB2 (1.00) ERBB2MINK1
SCHEMBL6579812 0.97 ERBB2 (0.95) ERBB2MINK1
SCHEMBL6579814 0.97 ERBB2 (0.95) ERBB2MINK1
Mubritinib SCHEMBL6758898 0.95 ERBB2 (0.91) ERBB2MINK1
Mubritinib SCHEMBL6758904 0.95 ERBB2 (0.91) ERBB2MINK1
Mubritinib SCHEMBL6760647 0.93 ERBB2 (0.88) ERBB2MINK1
Mubritinib SCHEMBL6760644 0.93 ERBB2 (0.88) ERBB2MINK1
Hydrochloric Acid SCHEMBL5521540 0.92 ERBB2 (0.83) ERBB2MINK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040106803-A1 Production method of 1-substituted-1,2,3-triazole derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-06-03 US disclosed
US-6743924-B2 EFFICIENT, HIGH YEILD SYNTHESIS OF TYROSINE KINASE INHIBITORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2004-06-01 US disclosed
EP-1310491-A1 METHOD FOR PRODUCING 1-SUBSTITUTED-1,2,3-TRIAZOLE DERIVATIVE Takeda Chemical Industries, Ltd. (JP) 2003-05-14 EP disclosed
US-20030069419-A1 Method for producing 1-substituted-1,2,3- triazole derivative TAKEDA PHARMACEUTICAL COMPANY, LIMITED (JP) 2003-04-10 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-20040106803-A1 Production method of 1-substituted-1,2,3-triazole derivatives ABL1, ROS1, ADH1A ERBB2 78/4885MINK1 359/4885
US-20030069419-A1 Method for producing 1-substituted-1,2,3- triazole derivative ABL1, YES1, MAP3K1 ERBB2 77/4885MINK1 330/4885

“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.