SCHEMBL180296

SCHEMBL180296

NC(=O)Nc1ccc(-n2cnc3cncnc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK2 Q9HBH9 1/20 0.46
MAPT P10636 3/20 0.45
TP53 P04637 1/20 0.45
HDAC6 Q9UBN7 2/20 0.39
HDAC1 Q13547 1/20 0.39
NPC1 O15118 4/20 0.38
RAB9A P51151 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TBXAS1 P24557 1/20 0.38
PEPD P12955 1/20 0.38
PTK2 Q05397 1/20 0.38
PTK2B Q14289 1/20 0.38
ALDH1A1 P00352 2/20 0.37
AURKA O14965 1/20 0.36
KDR P35968 1/20 0.36
AURKB Q96GD4 1/20 0.36
FDPS P14324 1/20 0.36
PDE10A Q9Y233 1/20 0.36
GAA P10253 1/20 0.36
GFER P55789 1/20 0.36

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
SCHEMBL17815611 0.82 CFTR (0.49) MKNK2MAPTTP53HDAC6HDAC1
SCHEMBL5112369 0.75 KDR (0.55) HDAC6HDAC1AURKAKDRAURKB
SCHEMBL1408354 0.75 QPCT (0.47) MKNK2MAPTHDAC6HDAC1TBXAS1
SCHEMBL680855 0.74 FGFR1 (0.56) MKNK2ALDH1A1
SCHEMBL1408497 0.73 RIPK1 (0.45) MKNK2MAPTHDAC6HDAC1NPC1
Hydrochloric Acid SCHEMBL4456679 0.72 FGFR1 (0.54) MKNK2ALDH1A1
SCHEMBL3697841 0.71 MKNK2 (0.49) MKNK2HDAC6HDAC1SMN1; SMN2ALDH1A1
SCHEMBL467133 0.71 MKNK2 (0.47) MKNK2HDAC6HDAC1ALDH1A1FDPS
SCHEMBL27337608 0.70 HDAC1 (0.42) MKNK2HDAC6HDAC1ALDH1A1FDPS
SCHEMBL17187988 0.69 MKNK2 (0.49) MKNK2HDAC6HDAC1SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9896730-B2 Use of EMT gene signatures in cancer drug discovery, diagnostics, and treatment OSI Pharmaceuticals, LLC (US) 2018-02-20 US disclosed
EP-2702173-A1 USE OF EMT GENE SIGNATURES IN CANCER DRUG DISCOVERY, DIAGNOSTICS, AND TREATMENT OSI Pharmaceuticals, LLC (US) 2014-03-05 EP disclosed
US-20140057352-A1 METHODS FOR THE IDENTIFICATION OF AGENTS THAT INHIBIT MESENCHYMAL-LIKE TUMOR CELLS OR THEIR FORMATION OSI PHARMACEUTICALS LLC (US) 2014-02-27 US disclosed
US-8642834-B2 Methods for the identification of agents that inhibit mesenchymal-like tumor cells or their formation OSI Pharmaceuticals, LLC (US) 2014-02-04 US disclosed
WO-2013152252-A1 COMBINATION ANTI-CANCER THERAPY OSI Pharmaceuticals, LLC (US) 2013-10-10 WO disclosed
US-20130210026-A1 BIOLOGICAL MARKERS PREDICTIVE OF ANTI-CANCER RESPONSE TO KINASE INHIBITORS OSI Pharmaceuticals, LLC 2013-08-15 US disclosed
US-8465912-B2 Methods for the identification of agents that inhibit mesenchymal-like tumor cells or their formation OSI Pharmaceuticals, LLC (US) 2013-06-18 US disclosed
US-8377636-B2 Biological markers predictive of anti-cancer response to kinase inhibitors OSI Pharmaceuticals, LLC (US) 2013-02-19 US disclosed
US-20120302572-A1 USE OF EMT GENE SIGNATURES IN CANCER DRUG DISCOVERY, DIAGNOSTICS, AND TREATMENT AVEO PHARMACEUTICALS, INC. (US) 2012-11-29 US disclosed
WO-2012149014-A1 USE OF EMT GENE SIGNATURES IN CANCER DRUG DISCOVERY, DIAGNOSTICS, AND TREATMENT OSI Pharmaceuticals, LLC (US) 2012-11-01 WO disclosed
WO-2009111067-A9 METHODS FOR THE IDENTIFICATION OF AGENTS THAT INHIBIT MESENCHYMAL -LIKE TUMOR CELLS OR THEIR FORMATION OSI PHARMACEUTICALS, INC. (US) 2009-12-23 WO disclosed
EP-2134860-A1 BIOLOGICAL MARKERS PREDICTIVE OF ANTI-CANCER RESPONSE TO KINASE INHIBITORS OSI Pharmaceuticals, Inc. (US) 2009-12-23 EP disclosed
US-20090274698-A1 Combination anti-cancer therapy OSI PHARMACEUTICALS, INC. 2009-11-05 US disclosed
US-20090263397-A1 Combination anti-cancer therapy OSI PHARMACEUTICALS, INC. 2009-10-22 US disclosed
WO-2009111067-A2 METHODS FOR THE IDENTIFICATION OF AGENTS THAT INHIBIT MESENCHYMAL -LIKE TUMOR CELLS OR THEIR FORMATION OSI PHARMACEUTICALS, INC. (US) 2009-09-11 WO disclosed
US-20090226396-A1 Methods for the identification of agents that inhibit mesenchymal-like tumor cells or their formation HALEY JOHN D 2009-09-10 US disclosed
WO-2009008992-A2 COMBINATION ANTI-CANCER THERAPY COMPRISING AN INHIBITOR OF BOTH MTORC1 AND MT0RC2 OSI PHARMACEUTICALS INC. (US) 2009-01-15 WO disclosed
WO-2009009016-A1 COMBINATION ANTI-CANCER THERAPY OSI PHARMACEUTICALS, INC. (US) 2009-01-15 WO disclosed
US-20080312260-A1 Biological markers predictive of anti-cancer response to kinase inhibitors HALEY JOHN D 2008-12-18 US disclosed
WO-2008127719-A1 BIOLOGICAL MARKERS PREDICTIVE OF ANTI-CANCER RESPONSE TO KINASE INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2008-10-23 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-20090263397-A1 Combination anti-cancer therapy IGF1R, IGFBP6, IGFBP1 MKNK2 447/4885MAPT 4658/4885TP53 125/4885
US-20120302572-A1 USE OF EMT GENE SIGNATURES IN CANCER DRUG DISCOVERY, DIAGNOSTICS, AND TREATMENT IGF1R, IGFBP1, EGFR MKNK2 87/4885MAPT 3190/4885TP53 785/4885
US-20090274698-A1 Combination anti-cancer therapy MTOR, RICTOR, AKT1 MKNK2 72/4885MAPT 4493/4885TP53 97/4885

“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.