SCHEMBL1927680

SCHEMBL1927680

Cc1ccc(C(=O)NCCN2CCCCC2)cc1Nc1nccc(-c2cccnc2)n1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 16/20 0.75
BCR P11274 15/20 0.75
ABCB1 P08183 4/20 0.62
PDGFRA P16234 4/20 0.60
LYN P07948 3/20 0.60
KIT P10721 3/20 0.60
PDGFRB P09619 3/20 0.60
PLK4 O00444 1/20 0.60
DDX3X O00571 1/20 0.60
GAK O14976 1/20 0.60
SLC22A2 O15244 1/20 0.60
MAPK13 O15264 1/20 0.60
CA12 O43570 1/20 0.60
SLC22A3 O75751 1/20 0.60
ABCB11 O95342 1/20 0.60
EGFR P00533 1/20 0.60
CA1 P00915 1/20 0.60
CA2 P00918 1/20 0.60
LMNA P02545 1/20 0.60
ALB P02768 1/20 0.60

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
SCHEMBL1653891 0.99 ABL1 (0.77) ABL1BCRABCB1PDGFRALYN
SCHEMBL1926898 0.92 ABL1 (0.66) ABL1BCRABCB1PDGFRALYN
SCHEMBL27549074 0.87 PDGFRA (0.61) ABL1BCRABCB1PDGFRALYN
SCHEMBL1928121 0.86 ABL1 (0.59) ABL1BCRABCB1PDGFRALYN
SCHEMBL1929409 0.84 PDGFRA (0.63) ABL1BCRPDGFRAKITPDGFRB
SCHEMBL1929347 0.84 PDGFRA (0.63) ABL1BCRPDGFRAKITPDGFRB
SCHEMBL1926875 0.84 ABL1 (0.59) ABL1BCRABCB1PDGFRALYN
SCHEMBL1927426 0.83 PDGFRA (0.58) ABL1BCRABCB1PDGFRALYN
SCHEMBL1928087 0.83 ABL1 (0.62) ABL1BCRPDGFRAKITPDGFRB
SCHEMBL6176992 0.82 PDGFRA (0.66) ABL1BCRPDGFRALYNKIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2368889-A1 Inhibitors of tyrosine kinases Novartis AG (CH) 2011-09-28 EP disclosed
US-20110218187-A1 INHIBITORS OF TYROSINE KINASES BREITENSTEIN WERNER 2011-09-08 US disclosed
EP-2357182-A1 Inhibitors of tyrosine kinases Novartis AG (CH) 2011-08-17 EP disclosed
US-7956053-B2 Inhibitors of tyrosine kinases NOVARTIS AG (CH) 2011-06-07 US disclosed
US-20090286821-A1 INHIBITORS OF TYROSINE KINASES BREITENSTEIN WERNER 2009-11-19 US disclosed
EP-2100891-A1 Inhibitors of tyrosine kinases Novartis AG (CH) 2009-09-16 EP disclosed
US-7569566-B2 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]-N-[5-(4-methyl-1H-imidazol1yl)-3-(trifluoromethyl)phenyl]benzamide or an N-oxide or salts; anticarcinogenic agent (leukaemia) NOVARTIS AG (CH) 2009-08-04 US disclosed
US-20080188451-A1 INHIBITORS OF TYROSINE KINASES BREITENSTEIN WERNER 2008-08-07 US disclosed
CN-101045727-A Inhibitors of tyrosine kinases NOVARTIS AG (CH) 2007-10-03 CN disclosed
CN-1324022-C Tyrosine kinase inhibitors NOVARTIS AG (CH) 2007-07-04 CN disclosed
US-20070093506-A1 Inhibitors of tyrosine kinases BREITENSTEIN WERNER 2007-04-26 US disclosed
US-7169791-B2 Inhibitors of tyrosine kinases NOVARTIS AG (CH) 2007-01-30 US disclosed
US-20060167015-A1 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]-N-[5-(4-methyl-1H-imidazol1yl)-3-(trifluoromethyl)phenyl]benzamide or an N-oxide or salts; anticarcinogenic agent (leukaemia) NOVARTIS AG (CH) 2006-07-27 US disclosed
CN-1675195-A Tyrosine kinase inhibitors NOVARTIS AG (CH) 2005-09-28 CN 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 (5 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-20070093506-A1 Inhibitors of tyrosine kinases ABL1, BTK, FLT3 ABL1 1/4885BCR 28/4885ABCB1 698/4885
US-20110218187-A1 INHIBITORS OF TYROSINE KINASES ABL1, BTK, FLT3 ABL1 1/4885BCR 28/4885ABCB1 698/4885
US-20080188451-A1 INHIBITORS OF TYROSINE KINASES ABL1, BTK, FLT3 ABL1 1/4885BCR 28/4885ABCB1 698/4885
US-20090286821-A1 INHIBITORS OF TYROSINE KINASES ABL1, BTK, FLT3 ABL1 1/4885BCR 28/4885ABCB1 698/4885
US-20060167015-A1 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]-N-[5-(4-methyl-1H-imidazol1yl)-3-(trifluoromethyl)phenyl]benzamide or an N-oxide or salts; anticarcinogenic agent (leukaemia) ABL1, CDK2, CDKN1A ABL1 1/4885BCR 181/4885ABCB1 1749/4885

“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.