SCHEMBL3594065

SCHEMBL3594065

FC(c1ccc2ncccc2c1)c1nnc2ccc(Cl)nn12

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MET P08581 19/20 0.56
PDE1A P54750 3/20 0.52
PDE4C Q08493 3/20 0.52
PDE4D Q08499 3/20 0.52
PDE3B Q13370 3/20 0.52
PDE1C Q14123 3/20 0.52
PDE3A Q14432 3/20 0.52
PDE11A Q9HCR9 3/20 0.52
PDE10A Q9Y233 3/20 0.52
PDE2A O00408 1/20 0.49
CHRM2 P08172 1/20 0.49
PDE4A P27815 1/20 0.49
PDE4B Q07343 1/20 0.49

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
SCHEMBL3599319 0.86 MET (0.73) METPDE1APDE4CPDE4DPDE3B
SCHEMBL2698471 0.86 MET (0.73) METPDE1APDE4CPDE4DPDE3B
SCHEMBL14199077 0.86 MET (0.55) METPDE1APDE4CPDE4DPDE3B
SCHEMBL9910508 0.86 MET (0.73) METPDE1APDE4CPDE4DPDE3B
SCHEMBL4200183 0.86 MET (0.73) METPDE1APDE4CPDE4DPDE3B
SCHEMBL9910375 0.84 MET (0.77) METPDE1APDE4CPDE4DPDE3B
SCHEMBL9910377 0.84 MET (0.77) METPDE1APDE4CPDE4DPDE3B
SCHEMBL12049407 0.81 MET (0.67) METPDE1APDE4CPDE4DPDE3B
SCHEMBL12049406 0.80 MET (0.65) METPDE1APDE4CPDE4DPDE3B
SCHEMBL14199032 0.79 MET (0.64) METPDE1APDE4CPDE4DPDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8071581-B2 Triazolopyridazine protein kinase modulators SGX PHARMACEUTICALS, INC. (US) 2011-12-06 US disclosed
US-8071581-B2 Triazolopyridazine protein kinase modulators SGX PHARMACEUTICALS, INC. (US) 2011-12-06 US disclosed
US-8071581-B2 Triazolopyridazine protein kinase modulators SGX PHARMACEUTICALS, INC. (US) 2011-12-06 US disclosed
US-20100120739-A1 TRIAZOLOPYRIDAZINE PROTEIN KINASE MODULATORS SGX PHARMACEUTICALS, INC. 2010-05-13 US disclosed
US-20100120739-A1 TRIAZOLOPYRIDAZINE PROTEIN KINASE MODULATORS SGX PHARMACEUTICALS, INC. 2010-05-13 US disclosed
US-20100120739-A1 TRIAZOLOPYRIDAZINE PROTEIN KINASE MODULATORS SGX PHARMACEUTICALS, INC. 2010-05-13 US disclosed
WO-2008051805-A2 TRIAZOLO-PYRIDAZINE PROTEIN KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2008-05-02 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 (1 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-20100120739-A1 TRIAZOLOPYRIDAZINE PROTEIN KINASE MODULATORS MAP4K5, MAPKAPK5, MAP4K2 MET 1025/4885PDE1A 287/4885PDE4C 478/4885

“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.