SCHEMBL12367149

SCHEMBL12367149

O=C1Nc2ncccc2Oc2nnccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.43
PLK4 O00444 1/20 0.43
AURKA O14965 1/20 0.43
CHEK2 O96017 1/20 0.43
LCK P06239 1/20 0.43
CDK2 P24941 1/20 0.43
MAPK8 P45983 1/20 0.43
CSNK1D P48730 1/20 0.43
GSK3A P49840 1/20 0.43
BLK P51451 1/20 0.43
CDK5 Q00535 1/20 0.43
STK3 Q13188 1/20 0.43
AURKB Q96GD4 1/20 0.43
CYP1A2 P05177 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 2/20 0.39
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.35
GAA P10253 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL477913 0.79 CDK2 (0.56) GSK3BPLK4AURKACHEK2LCK
SCHEMBL12367151 0.78 GSK3B (0.51) GSK3BPLK4AURKACHEK2LCK
SCHEMBL12367150 0.71 CDK2 (0.43) GSK3BPLK4AURKACHEK2LCK
SCHEMBL12367153 0.71 CDK2 (0.43) GSK3BPLK4AURKACHEK2LCK
SCHEMBL12367147 0.71 PLK4 (0.37) GSK3BPLK4AURKACHEK2LCK
SCHEMBL1367080 0.69 CYP1A2 (0.55) GSK3BPLK4AURKACHEK2LCK
SCHEMBL6015921 0.69 MEN1 (0.62) CYP1A2SMN1; SMN2NPC1MAPTALDH1A1
SCHEMBL6015927 0.69 MEN1 (0.62) CYP1A2SMN1; SMN2NPC1MAPTALDH1A1
SCHEMBL12367146 0.69 PLK4 (0.38) GSK3BPLK4AURKACHEK2LCK
SCHEMBL12690199 0.67 STK17B (0.58) GSK3BSMN1; SMN2MAPTALDH1A1GAA

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-7994160-B2 Pyridazine compounds as glycogen synthase kinase 3 inhibitors ABBOTT GMBH & CO. KG (DE) 2011-08-09 US disclosed
US-20090325937-A1 Pyridazine Compounds as Glycogen Synthase Kinase 3 Inhibitors ABBOTT GMBH & CO. KG (DE) 2009-12-31 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-20090325937-A1 Pyridazine Compounds as Glycogen Synthase Kinase 3 Inhibitors GSK3B, GSK3A, GYS2 GSK3B 1/4885PLK4 39/4885AURKA 337/4885

“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.