Nilotinib

Nilotinib

SCHEMBL9990634

Br.Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1

nearest known ligand 0.99

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1BCR

The experimentally established mechanism targets of Nilotinib. 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
ABL1 known ✓ P00519 16/20 0.99
BCR known ✓ P11274 8/20 0.99
KIT P10721 11/20 0.99
LDLR P01130 8/20 0.99
PCSK9 Q8NBP7 8/20 0.99
PDGFRB P09619 6/20 0.99
LCK P06239 4/20 0.99
LYN P07948 4/20 0.99
PDGFRA P16234 4/20 0.99
FLT3 P36888 4/20 0.99
DDR2 Q16832 4/20 0.99
ADORA3 P0DMS8 2/20 0.99
SRC P12931 2/20 0.99
EPHB6 O15197 1/20 0.99
CA12 O43570 1/20 0.99
CACNA1F O60840 1/20 0.99
SLC22A3 O75751 1/20 0.99
STK10 O94804 1/20 0.99
CA1 P00915 1/20 0.99
CA2 P00918 1/20 0.99

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
Nilotinib SCHEMBL29580067 0.99 ABL1 (1.00) ABL1KITBCRLDLRPCSK9
Nilotinib SCHEMBL7901 0.99 ABL1 (1.00) ABL1KITBCRLDLRPCSK9
Nilotinib SCHEMBL29366964 0.99 ABL1 (1.00) ABL1KITBCRLDLRPCSK9
Nilotinib SCHEMBL28569394 0.99 ABL1 (0.99) ABL1KITBCRLDLRPCSK9
Nilotinib SCHEMBL434496 0.99 ABL1 (0.99) ABL1KITBCRLDLRPCSK9
Nilotinib SCHEMBL1984397 0.99 ABL1 (0.99) ABL1KITBCRLDLRPCSK9
Nilotinib SCHEMBL28656586 0.99 ABL1 (0.99) ABL1KITBCRLDLRPCSK9
Nilotinib SCHEMBL31005052 0.99 ABL1 (0.99) ABL1KITBCRLDLRPCSK9
Nilotinib SCHEMBL1459790 0.99 ABL1 (0.99) ABL1KITBCRLDLRPCSK9
Nilotinib SCHEMBL26181009 0.99 ABL1 (0.99) ABL1KITBCRLDLRPCSK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116635015-A Pharmaceutical composition 深圳市药欣生物科技有限公司 2023-08-22 CN claimed
EP-4221690-A1 PHARMACEUTICAL COMPOSITIONS Shenzhen Pharmacin Co., Ltd. (CN) 2023-08-09 EP claimed
EP-2966072-A2 CRYSTALLINE FORMS OF NILOTINIB HYDROBROMIDE, SUCCINATE, GLUTAMATE, ACETATE, L-MALATE AND MALEATE TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2016-01-13 EP claimed
US-8937082-B2 Nilotinib salts and crystalline forms thereof TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2015-01-20 US claimed
US-20130158059-A1 NILOTINIB SALTS AND CRYSTALLINE FORMS THEREOF TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2013-06-20 US claimed
EP-2571863-A1 NILOTINIB SALTS AND CRYSTALLINE FORMS THEREOF Teva Pharmaceutical Industries Ltd. (IL) 2013-03-27 EP claimed
WO-2011163222-A1 NILOTINIB SALTS AND CRYSTALLINE FORMS THEREOF TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2011-12-29 WO claimed
US-20230414613-A1 PHARMACEUTICAL COMPOSITIONS Shenzhen Pharmacin Co., Ltd. (CN) 2023-12-28 US disclosed
CN-116635015-A Pharmaceutical composition 深圳市药欣生物科技有限公司 2023-08-22 CN disclosed
EP-4221690-A1 PHARMACEUTICAL COMPOSITIONS Shenzhen Pharmacin Co., Ltd. (CN) 2023-08-09 EP disclosed
CN-112294971-B Nilotinib compositions having improved solubility 深圳市泰力生物医药有限公司 2022-02-01 CN disclosed
CN-112294971-A Nilotinib compositions having improved solubility 深圳市泰力生物医药有限公司 2021-02-02 CN disclosed
EP-2909191-B1 MULTICOMPONENT CRYSTALLINE SYSTEM COMPRISING NILOTINIB AND SELECTED CO-CRYSTAL FORMERS BASF SE (DE) 2019-03-20 EP disclosed
WO-2015092624-A1 NILOTINIB MONO-OXALATE AND ITS CRYSTALLINE FORM RANBAXY LABORATORIES LIMITED (IN) 2015-06-25 WO disclosed
US-20150099885-A1 Nilotinib Salts And Crystalline Forms Thereof TEVA PHARMA (IL) 2015-04-09 US disclosed
US-8937082-B2 Nilotinib salts and crystalline forms thereof TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2015-01-20 US disclosed
WO-2014060449-A1 MULTICOMPONENT CRYSTALLINE SYSTEM COMPRISING NILOTINIB AND SELECTED CO-CRYSTAL FORMERS BASF SE (DE) 2014-04-24 WO disclosed
US-20130158059-A1 NILOTINIB SALTS AND CRYSTALLINE FORMS THEREOF TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2013-06-20 US disclosed
EP-2571863-A1 NILOTINIB SALTS AND CRYSTALLINE FORMS THEREOF Teva Pharmaceutical Industries Ltd. (IL) 2013-03-27 EP disclosed
WO-2011163222-A1 NILOTINIB SALTS AND CRYSTALLINE FORMS THEREOF TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2011-12-29 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 (3 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-20230414613-A1 PHARMACEUTICAL COMPOSITIONS ABL1, ABCG2, LIPA ABL1 1/4885BCR 89/4885KIT 247/4885
US-20150099885-A1 Nilotinib Salts And Crystalline Forms Thereof ABL1, TP53, NRAS ABL1 1/4885BCR 24/4885KIT 1401/4885
US-20130158059-A1 NILOTINIB SALTS AND CRYSTALLINE FORMS THEREOF ABL1, TP53, NRAS ABL1 1/4885BCR 24/4885KIT 1401/4885

“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.