SCHEMBL2949526

SCHEMBL2949526

NC(c1ccncc1)c1ccc2ncc(-c3cc4ccccc4s3)n2n1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.52
PIK3R1 P27986 1/20 0.52
FYN P06241 15/20 0.40
TBK1 Q9UHD2 1/20 0.38
MKNK1 Q9BUB5 4/20 0.38
EIF4E P06730 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38

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
SCHEMBL2951381 0.87 PIK3CD (0.49) PIK3CDPIK3R1FYNMKNK1EIF4E
SCHEMBL2945059 0.81 FYN (0.45) FYNMKNK1MKNK2
SCHEMBL16023579 0.79 PIK3CD (0.55) PIK3CDPIK3R1FYNTBK1MKNK1
SCHEMBL2950866 0.77 MKNK1 (0.60) FYNMKNK1MKNK2
SCHEMBL13234229 0.76 MKNK1 (0.55) PIK3CDPIK3R1FYNMKNK1EIF4E
SCHEMBL2949528 0.75 PIK3CD (0.70) PIK3CDPIK3R1FYNMKNK1
SCHEMBL2944596 0.75 FYN (0.63) FYN
SCHEMBL2949820 0.75 FYN (0.49) FYN
SCHEMBL2951001 0.74 MKNK1 (0.47) FYNMKNK1
SCHEMBL2945913 0.74 FYN (0.49) FYNMKNK1

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-7750000-B2 Substituted imidazo[1,2b]pyridazines as kinase inhibitors, their preparation and use as medicaments BAYER SCHERING PHARMA AG (DE) 2010-07-06 US disclosed
US-20070093490-A1 Substituted imidazo[1,2b]pyridazines as kinase inhibitors, their preparation and use as medicaments BAYER INTELLECTUAL PROPERTY GMBH (DE) 2007-04-26 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-20070093490-A1 Substituted imidazo[1,2b]pyridazines as kinase inhibitors, their preparation and use as medicaments MAP4K2, MAP3K1, MAP3K2 PIK3CD 101/4885PIK3R1 410/4885FYN 421/4885

“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.