SCHEMBL2286993

SCHEMBL2286993

CNc1nc(C)c(-c2ccnc(Nc3cc(OC)ccc3OC)n2)s1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK2 Q9HBH9 11/20 0.85
FLT3 P36888 6/20 0.85
MKNK1 Q9BUB5 4/20 0.85
CDK2 P24941 7/20 0.68
CDK4 P11802 5/20 0.68
CDK1 P06493 5/20 0.68
CDK7 P50613 5/20 0.68
CDK9 P50750 5/20 0.68
AURKA O14965 3/20 0.68
AURKB Q96GD4 3/20 0.68
CCNA2 P20248 3/20 0.56
PLK1 P53350 1/20 0.56
MEN1 O00255 2/20 0.53
GAA P10253 2/20 0.53
MAPT P10636 2/20 0.53
KMT2A Q03164 2/20 0.53
MAPK1 P28482 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
ALDH1A1 P00352 1/20 0.53
HSD17B10 Q99714 1/20 0.53

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
SCHEMBL2288624 0.86 MEN1 (0.67) MKNK2FLT3MKNK1CDK2CDK4
SCHEMBL2289365 0.84 MKNK2 (0.64) MKNK2FLT3MKNK1CDK2CDK4
SCHEMBL2290877 0.84 MKNK2 (0.66) MKNK2FLT3MKNK1CDK2CDK4
SCHEMBL2284183 0.84 MKNK2 (0.63) MKNK2FLT3MKNK1CDK2CDK4
SCHEMBL6159400 0.84 CDK2 (0.75) MKNK2FLT3MKNK1CDK2CDK4
SCHEMBL4164019 0.83 CDK2 (0.77) MKNK2FLT3MKNK1CDK2CDK4
SCHEMBL4164452 0.82 CDK2 (0.76) MKNK2FLT3MKNK1CDK2CDK4
SCHEMBL2286476 0.82 CDK2 (0.74) MKNK2FLT3MKNK1CDK2CDK4
SCHEMBL4156619 0.81 CDK2 (1.00) MKNK2FLT3MKNK1CDK2CDK4
SCHEMBL4161732 0.80 AURKA (0.65) MKNK2FLT3MKNK1CDK2CDK4

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-20110195968-A1 THIAZOLES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2011-08-11 US disclosed
US-20090030024-A1 THIAZOLES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2009-01-29 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 (2 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-20090030024-A1 THIAZOLES AS FUNGICIDES CYP4X1, CYP4Z1, RDX MKNK2 4101/4885FLT3 216/4885MKNK1 4404/4885
US-20110195968-A1 THIAZOLES AS FUNGICIDES CYP4X1, CYP4Z1, CYP3A4 MKNK2 4185/4885FLT3 211/4885MKNK1 4474/4885

“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.