SCHEMBL12049397

SCHEMBL12049397

CC(F)(c1ccc2ncccc2c1)c1nnc2ccc(-c3cccc(F)c3)nn12

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MET P08581 19/20 0.68
PDE3B Q13370 3/20 0.61
PDE3A Q14432 3/20 0.61
NQO2 P16083 1/20 0.61
PIP4K2C Q8TBX8 1/20 0.61
PDE1A P54750 2/20 0.50
PDE4C Q08493 2/20 0.50
PDE4D Q08499 2/20 0.50
PDE1C Q14123 2/20 0.50
PDE11A Q9HCR9 2/20 0.50
PDE10A Q9Y233 2/20 0.50

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
SCHEMBL10242471 0.91 MET (0.71) METPDE3BPDE3ANQO2PIP4K2C
SCHEMBL12049487 0.91 MET (0.81) METPDE3BPDE3ANQO2PIP4K2C
SCHEMBL14199066 0.90 MET (0.67) METPDE3BPDE3ANQO2PIP4K2C
SCHEMBL10242499 0.88 MET (0.66) METPDE3BPDE3ANQO2PIP4K2C
SCHEMBL12049398 0.87 MET (0.64) METPDE3BPDE3ANQO2PIP4K2C
SCHEMBL10242512 0.87 MET (0.73) METPDE3BPDE3ANQO2PIP4K2C
SCHEMBL10242511 0.83 MET (0.65) METPDE3BPDE3ANQO2PIP4K2C
SCHEMBL12049429 0.82 MET (0.45) METPDE3BPDE3ANQO2PIP4K2C
SCHEMBL9910501 0.82 MET (0.86) METPDE3BPDE3ANQO2PIP4K2C
SCHEMBL12049424 0.82 MET (0.57) METPDE3BPDE3ANQO2PIP4K2C

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 5 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-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 1025/4885PDE3B 600/4885PDE3A 568/4885

“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.