SCHEMBL4301301

SCHEMBL4301301

C/N=C\c1ccc2nnc(C(C)C)n2n1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 2/20 0.33
MAPK9 P45984 2/20 0.33
CSNK1D P48730 2/20 0.33
MINK1 Q8N4C8 2/20 0.33
PRKD2 Q9BZL6 2/20 0.33
PRKD3 O94806 1/20 0.33
EGFR P00533 1/20 0.32
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
MET P08581 1/20 0.30

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
SCHEMBL4301304 1.00 MAP4K4 (0.33) MAP4K4MAPK9CSNK1DMINK1PRKD2
SCHEMBL8990186 1.00 MAP4K4 (0.33) MAP4K4MAPK9CSNK1DMINK1PRKD2
SCHEMBL3245463 0.81 MAP4K4 (0.34) MAP4K4MAPK9CSNK1DMINK1PRKD2
SCHEMBL3237339 0.81 KDM4E (0.34) MAP4K4MAPK9CSNK1DMINK1PRKD2
SCHEMBL12891156 0.73 MET (0.36) MAP4K4MAPK9CSNK1DMINK1PRKD2
SCHEMBL4817342 0.71 MAP4K4 (0.38) MAP4K4MAPK9CSNK1DMINK1PRKD2
SCHEMBL937870 0.71 KDM4E (0.58) MAP4K4MAPK9CSNK1DMINK1PRKD2
SCHEMBL17229853 0.66 KDM4E (0.35) MAP4K4MAPK9CSNK1DMINK1PRKD2
SCHEMBL4298715 0.65 MET (0.34) MAP4K4MAPK9CSNK1DMINK1PRKD2
SCHEMBL15359688 0.64 APLNR (0.36) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188083-B2 Triazolopyridazines ABBOTT LABORATORIES (US) 2012-05-29 US disclosed
US-20090270402-A1 Novel triazolopyridazines ABBVIE INC. 2009-10-29 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 (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-20090270402-A1 Novel triazolopyridazines MAP3K5, MAP3K1, MAP3K2 MAP4K4 24/4885MAPK9 101/4885CSNK1D 173/4885

“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.