Bosutinib

Bosutinib

SCHEMBL2887945

COc1cc(Nc2c(C#N)cnc3cc(OCCCN4CCN(C)CC4)c(OC)cc23)c(Cl)cc1Cl.O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1BCRHCKLYNSRC

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC known ✓ P12931 19/20 1.00
ABL1 known ✓ P00519 5/20 1.00
BCR known ✓ P11274 4/20 1.00
LYN known ✓ P07948 1/20 1.00
HCK known ✓ P08631 1/20 1.00
FYN P06241 2/20 1.00
KCNH2 Q12809 2/20 1.00
ABL2 P42684 2/20 1.00
WEE2 P0C1S8 2/20 1.00
WEE1 P30291 2/20 1.00
PKMYT1 Q99640 2/20 1.00
STK25 O00506 1/20 1.00
CIT O14578 1/20 1.00
RIOK3 O14730 1/20 1.00
MAP2K7 O14733 1/20 1.00
CHEK1 O14757 1/20 1.00
CASK O14936 1/20 1.00
GAK O14976 1/20 1.00
EPHB6 O15197 1/20 1.00
MAP3K13 O43283 1/20 1.00

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
Bosutinib SCHEMBL19207253 1.00 SRC (1.00) SRCABL1BCRFYNKCNH2
Bosutinib SCHEMBL29389315 1.00 SRC (1.00) SRCABL1BCRFYNKCNH2
Bosutinib SCHEMBL29428159 1.00 SRC (1.00) SRCABL1BCRFYNKCNH2
Bosutinib SCHEMBL29350234 1.00 SRC (1.00) SRCABL1BCRFYNKCNH2
Bosutinib SCHEMBL158390 1.00 SRC (1.00) SRCABL1BCRFYNKCNH2
Bosutinib SCHEMBL19207270 0.98 SRC (0.97) SRCABL1BCRFYNKCNH2
Bosutinib SCHEMBL19207277 0.96 SRC (0.92) SRCABL1BCRFYNKCNH2
SCHEMBL676669 0.96 SRC (0.92) SRCABL1BCRFYNKCNH2
SCHEMBL30453343 0.96 SRC (0.92) SRCABL1BCRFYNKCNH2
SCHEMBL30453317 0.96 SRC (0.92) SRCABL1BCRFYNKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1902029-B2 CRYSTALLINE FORMS OF 4-[(2,4-DICHLORO-5-METHOXYPHENYL)AMINO]-6-METHOXY-7-[3-(4-METHYL-1-PIPERAZINYL)PROPOXY]-3-QUINOLINECARB-ONITRILE AND METHODS OF PREPARING THE SAME WYETH LLC (US) 2022-02-16 EP claimed
EP-1902029-B1 CRYSTALLINE FORMS OF 4-[(2,4-DICHLORO-5-METHOXYPHENYL)AMINO]-6-METHOXY-7-[3-(4-METHYL-1-PIPERAZINYL)PROPOXY]-3-QUINOLINECARB-ONITRILE AND METHODS OF PREPARING THE SAME WYETH LLC (US) 2014-01-08 EP claimed
US-8445496-B2 Crystalline forms of 4-[(2,4-dichloro-5-methoxyphenyl)amino]-6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]-3-quinolinecarbonitrile and methods of preparing the same WYETH LLC (US) 2013-05-21 US claimed
US-20100324066-A1 CRYSTALLINE FORMS OF 4-[(2,4-DICHLORO-5-METHOXYPHENYL)AMINO]-6-METHOXY-7-[3-(4-METHYL-1-PIPERAZINYL)PROPOXY]-3-QUINOLINECARBONITRILE AND METHODS OF PREPARING THE SAME WYETH LLC (US) 2010-12-23 US claimed
US-7767678-B2 Crystalline forms of 4-[(2,4-dichloro-5-methoxyphenyl)amino]-6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]-3-quinolinecarbonitrile and methods of preparing the same WYETH LLC (US) 2010-08-03 US claimed
EP-1902029-A1 CRYSTALLINE FORMS OF 4-[(2,4-DICHLORO-5-METHOXYPHENYL)AMINO]-6-METHOXY-7-[3-(4-METHYL-1-PIPERAZINYL)PROPOXY]-3-QUINOLINECARB-ONITRILE AND METHODS OF PREPARING THE SAME Wyeth a Corporation of the State of Delaware (US) 2008-03-26 EP claimed
US-20070015767-A1 Crystalline forms of 4-[(2,4-dichloro-5-methoxyphenyl)amino]-6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]-3-quinolinecarbonitrile and methods of preparing the same WYETH LLC 2007-01-18 US claimed
WO-2007005462-A1 CRYSTALLINE FORMS OF 4-[(2,4-DICHLORO-5-METHOXYPHENYL)AMINO]-6-METHOXY-7-[3-(4-METHYL-1-PIPERAZINYL)PROPOXY]-3-QUINOLINECARB-ONITRILE AND METHODS OF PREPARING THE SAME WYETH (US) 2007-01-11 WO claimed
EP-4378478-A1 MEDICAMENT FOR TREATMENT AND/OR PREVENTION OF CANCER Toray Industries, Inc. (JP) 2024-06-05 EP disclosed
CN-111646955-B Method for preparing bosutinib intermediate 鲁南制药集团股份有限公司 2024-05-24 CN disclosed
CN-111646940-B Preparation method of bosutinib intermediate 鲁南制药集团股份有限公司 2024-01-30 CN disclosed
EP-1902029-B2 CRYSTALLINE FORMS OF 4-[(2,4-DICHLORO-5-METHOXYPHENYL)AMINO]-6-METHOXY-7-[3-(4-METHYL-1-PIPERAZINYL)PROPOXY]-3-QUINOLINECARB-ONITRILE AND METHODS OF PREPARING THE SAME WYETH LLC (US) 2022-02-16 EP disclosed
CN-111646940-A Preparation method of bosutinib intermediate 鲁南制药集团股份有限公司 2020-09-11 CN disclosed
CN-111646955-A Method for preparing bosutinib intermediate 鲁南制药集团股份有限公司 2020-09-11 CN disclosed
EP-1902029-A1 CRYSTALLINE FORMS OF 4-[(2,4-DICHLORO-5-METHOXYPHENYL)AMINO]-6-METHOXY-7-[3-(4-METHYL-1-PIPERAZINYL)PROPOXY]-3-QUINOLINECARB-ONITRILE AND METHODS OF PREPARING THE SAME Wyeth a Corporation of the State of Delaware (US) 2008-03-26 EP disclosed
EP-1902029-A1 CRYSTALLINE FORMS OF 4-[(2,4-DICHLORO-5-METHOXYPHENYL)AMINO]-6-METHOXY-7-[3-(4-METHYL-1-PIPERAZINYL)PROPOXY]-3-QUINOLINECARB-ONITRILE AND METHODS OF PREPARING THE SAME Wyeth a Corporation of the State of Delaware (US) 2008-03-26 EP disclosed
US-20070015767-A1 Crystalline forms of 4-[(2,4-dichloro-5-methoxyphenyl)amino]-6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]-3-quinolinecarbonitrile and methods of preparing the same WYETH LLC 2007-01-18 US disclosed
US-20070015767-A1 Crystalline forms of 4-[(2,4-dichloro-5-methoxyphenyl)amino]-6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]-3-quinolinecarbonitrile and methods of preparing the same WYETH LLC 2007-01-18 US disclosed
WO-2007005462-A1 CRYSTALLINE FORMS OF 4-[(2,4-DICHLORO-5-METHOXYPHENYL)AMINO]-6-METHOXY-7-[3-(4-METHYL-1-PIPERAZINYL)PROPOXY]-3-QUINOLINECARB-ONITRILE AND METHODS OF PREPARING THE SAME WYETH (US) 2007-01-11 WO disclosed
WO-2007005462-A1 CRYSTALLINE FORMS OF 4-[(2,4-DICHLORO-5-METHOXYPHENYL)AMINO]-6-METHOXY-7-[3-(4-METHYL-1-PIPERAZINYL)PROPOXY]-3-QUINOLINECARB-ONITRILE AND METHODS OF PREPARING THE SAME WYETH (US) 2007-01-11 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 (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-20070015767-A1 Crystalline forms of 4-[(2,4-dichloro-5-methoxyphenyl)amino]-6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]-3-quinolinecarbonitrile and methods of preparing the same NT5C, KDM4C, TUBA3C SRC 2568/4885ABL1 160/4885BCR 3005/4885
US-20100324066-A1 CRYSTALLINE FORMS OF 4-[(2,4-DICHLORO-5-METHOXYPHENYL)AMINO]-6-METHOXY-7-[3-(4-METHYL-1-PIPERAZINYL)PROPOXY]-3-QUINOLINECARBONITRILE AND METHODS OF PREPARING THE SAME NT5C, KDM4C, TUBA3C SRC 2568/4885ABL1 160/4885BCR 3005/4885

“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.