SCHEMBL12013383

SCHEMBL12013383

CC(=O)Nc1cc(Nc2cc(N)c3ncc(C#N)n3n2)ccc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A1 P68400 12/20 0.39
▸ CSNK2A2 P19784 11/20 0.39
▸ CSNK2B P67870 11/20 0.39
▸ KCNH2 Q12809 4/20 0.39
▸ DYRK3 O43781 4/20 0.39
▸ CDK2 P24941 3/20 0.39
▸ HIPK2 Q9H2X6 2/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ PIM3 Q86V86 1/20 0.39
▸ DYRK1A Q13627 3/20 0.37
▸ DYRK2 Q92630 3/20 0.37
▸ DYRK1B Q9Y463 3/20 0.37
▸ DAPK3 O43293 1/20 0.37
▸ HIPK1 Q86Z02 1/20 0.37
▸ HIPK4 Q8NE63 1/20 0.37
▸ HIPK3 Q9H422 1/20 0.37
▸ DYRK4 Q9NR20 1/20 0.37
▸ DAPK2 Q9UIK4 1/20 0.37
▸ CCNT1 O60563 2/20 0.36
▸ CCNA2 P20248 2/20 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
SCHEMBL2358803 0.85 CSNK2A1 (0.49) CSNK2A1CSNK2A2CSNK2BKCNH2DYRK3
SCHEMBL3309971 0.83 CSNK2A2 (0.42) CSNK2A1CSNK2A2CSNK2BKCNH2DYRK3
SCHEMBL12012939 0.80 EGFR (0.41) CSNK2A1CSNK2A2CSNK2BKCNH2DYRK3
SCHEMBL3313747 0.78 FLT3 (0.39) CSNK2A1CSNK2A2EGLN2
SCHEMBL13421572 0.76 KCNH2 (0.44) CSNK2A1CSNK2A2CSNK2BKCNH2DYRK3
SCHEMBL3313444 0.76 KCNH2 (0.48) CSNK2A1CSNK2A2CSNK2BKCNH2DYRK3
SCHEMBL2309711 0.76 CSNK2A2 (0.40) CSNK2A1CSNK2A2CSNK2BKCNH2DYRK3
SCHEMBL15084633 0.75 RPS27 (0.44) CSNK2A1CSNK2A2
SCHEMBL2358275 0.75 TYK2 (0.35) CSNK2A1CSNK2A2CSNK2BKCNH2DYRK3
SCHEMBL12013395 0.75 CSNK2A1 (0.50) CSNK2A1CSNK2A2CSNK2BKCNH2DYRK3

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-8252795-B2 Imidazopyridazinecarbonitriles useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2012-08-28 — — US disclosed
US-20100113458-A1 IMIDAZOPYRIDAZINECARBONITRILES USEFUL AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2010-05-06 — — 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-20100113458-A1 IMIDAZOPYRIDAZINECARBONITRILES USEFUL AS KINASE INHIBITORS MAP3K5, MAP3K15, MAP4K2 CSNK2A1 88/4885CSNK2A2 135/4885CSNK2B 140/4885

“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.

Send feedback