SCHEMBL1928115

SCHEMBL1928115

COc1ccc(CNC(=O)c2ccc(C)c(Nc3nccc(-c4cccnc4)n3)c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 15/20 0.66
KIT P10721 7/20 0.66
KDR P35968 3/20 0.64
ABL1 P00519 11/20 0.61
BCR P11274 9/20 0.61
PDGFRB P09619 7/20 0.61
HDAC3 O15379 2/20 0.59
HDAC2 Q92769 2/20 0.59
NCOR1 O75376 1/20 0.59
HDAC4 P56524 1/20 0.59
HDAC1 Q13547 1/20 0.59
HDAC7 Q8WUI4 1/20 0.59
HDAC10 Q969S8 1/20 0.59
HDAC11 Q96DB2 1/20 0.59
HDAC8 Q9BY41 1/20 0.59
HDAC6 Q9UBN7 1/20 0.59
HDAC9 Q9UKV0 1/20 0.59
HDAC5 Q9UQL6 1/20 0.59
PRKCA P17252 2/20 0.57
EGFR P00533 1/20 0.57

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
SCHEMBL1928330 0.90 PDGFRA (0.68) PDGFRAKITKDRABL1BCR
SCHEMBL1927086 0.88 ABL1 (0.66) PDGFRAKITKDRABL1BCR
SCHEMBL27606811 0.88 PDGFRA (0.66) PDGFRAKITKDRABL1BCR
SCHEMBL1927341 0.87 PDGFRA (0.65) PDGFRAKITKDRABL1BCR
SCHEMBL1929253 0.87 PDGFRA (0.67) PDGFRAKITKDRABL1BCR
SCHEMBL1926503 0.87 PDGFRA (0.64) PDGFRAKITKDRABL1BCR
SCHEMBL1929347 0.85 PDGFRA (0.63) PDGFRAKITKDRABL1BCR
SCHEMBL1929917 0.85 ABL1 (0.63) PDGFRAKITKDRABL1BCR
SCHEMBL1928830 0.84 ABL1 (0.67) PDGFRAKITKDRABL1BCR
SCHEMBL1654414 0.84 PDGFRA (0.65) PDGFRAKITKDRABL1BCR

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 11 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
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

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 PDGFRA 382/4885KIT 254/4885KDR 312/4885
US-20110218187-A1 INHIBITORS OF TYROSINE KINASES ABL1, BTK, FLT3 PDGFRA 382/4885KIT 254/4885KDR 312/4885
US-20080188451-A1 INHIBITORS OF TYROSINE KINASES ABL1, BTK, FLT3 PDGFRA 382/4885KIT 254/4885KDR 312/4885
US-20090286821-A1 INHIBITORS OF TYROSINE KINASES ABL1, BTK, FLT3 PDGFRA 382/4885KIT 254/4885KDR 312/4885
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 PDGFRA 440/4885KIT 667/4885KDR 1906/4885

“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.