SCHEMBL2497412

SCHEMBL2497412

Cn1cc(-c2ccc3nnc(Cc4ccc5c(ccc[n+]5[O-])c4)n3n2)cn1

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MET P08581 20/20 0.69
NQO2 P16083 2/20 0.45
PDE3B Q13370 2/20 0.45
PDE3A Q14432 2/20 0.45
PIP4K2C Q8TBX8 2/20 0.45
ABL1 P00519 1/20 0.44
MAPK8 P45983 1/20 0.44
MAPK10 P53779 1/20 0.44
DYRK1A Q13627 1/20 0.44
MAP3K19 Q56UN5 1/20 0.44
DYRK1B Q9Y463 1/20 0.44

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
SCHEMBL2492185 0.82 MET (1.00) METNQO2PDE3BPDE3APIP4K2C
SCHEMBL17814800 0.80 MET (0.70) METNQO2PDE3BPDE3APIP4K2C
SCHEMBL3261914 0.79 MET (0.78) METNQO2PDE3BPDE3APIP4K2C
SCHEMBL1133654 0.78 MET (0.65) METNQO2PDE3BPDE3APIP4K2C
SCHEMBL2495123 0.78 MET (0.76) METNQO2PDE3BPDE3APIP4K2C
SCHEMBL2494598 0.77 MET (0.79) METNQO2PDE3BPDE3APIP4K2C
SCHEMBL12049136 0.77 MET (0.74) METNQO2PDE3BPDE3APIP4K2C
SCHEMBL12049139 0.76 MET (0.68) METNQO2PDE3BPDE3APIP4K2C
SCHEMBL9910504 0.76 MET (0.77) METNQO2PDE3BPDE3APIP4K2C
SCHEMBL12049135 0.76 MET (0.73) METNQO2PDE3BPDE3APIP4K2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1966214-B9 TRIAZOLOPYRIDAZINES AS TYROSINE KINASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2017-09-13 EP disclosed
EP-1966214-B1 TRIAZOLOPYRIDAZINES AS TYROSINE KINASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2016-11-02 EP disclosed
US-8173654-B2 Triazolopyridazine compounds JANSSEN PHARMACEUTICA N.V. (BE) 2012-05-08 US disclosed
US-8173654-B2 Triazolopyridazine compounds JANSSEN PHARMACEUTICA N.V. (BE) 2012-05-08 US disclosed
US-8030305-B2 Triazolopyridazines as kinase modulators JANSSEN PHARMACEUTICA N.V. (BE) 2011-10-04 US disclosed
US-20090098181-A1 TRIAZOLOPYRIDAZINES AS KINASE MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2009-04-16 US disclosed
US-20090098181-A1 TRIAZOLOPYRIDAZINES AS KINASE MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2009-04-16 US disclosed
US-20070203136-A1 TRIAZOLOPYRIDAZINES AS KINASE MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-08-30 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 (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-20070203136-A1 TRIAZOLOPYRIDAZINES AS KINASE MODULATORS RET, MET, ABL1 MET 2/4885NQO2 2644/4885PDE3B 859/4885
US-20090098181-A1 TRIAZOLOPYRIDAZINES AS KINASE MODULATORS RET, MET, ABL1 MET 2/4885NQO2 2644/4885PDE3B 859/4885

“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.