SCHEMBL2283592

SCHEMBL2283592

CNc1nc(C)c(-c2ccnc(Nc3ccc(C#N)cc3)n2)s1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 17/20 0.73
CDK4 P11802 11/20 0.73
CCNA2 P20248 5/20 0.73
PLK1 P53350 2/20 0.73
CDK9 P50750 10/20 0.65
CDK7 P50613 7/20 0.65
AURKA O14965 6/20 0.65
AURKB Q96GD4 5/20 0.65
WEE1 P30291 2/20 0.65
ALK Q9UM73 2/20 0.65
FLT3 P36888 2/20 0.65
CHEK1 O14757 1/20 0.65
DAPK3 O43293 1/20 0.65
JAK2 O60674 1/20 0.65
PRKD3 O94806 1/20 0.65
PAK4 O96013 1/20 0.65
ABL1 P00519 1/20 0.65
FYN P06241 1/20 0.65
CSF1R P07333 1/20 0.65
RET P07949 1/20 0.65

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
SCHEMBL2281563 0.87 CDK2 (0.76) CDK2CDK4PLK1CDK9CDK7
SCHEMBL2283552 0.85 CDK2 (0.73) CDK2CDK4CCNA2PLK1CDK9
SCHEMBL6158084 0.85 CDK2 (0.78) CDK2CDK4CCNA2PLK1CDK9
SCHEMBL4312523 0.85 CDK2 (1.00) CDK2CDK4CCNA2PLK1CDK9
SCHEMBL2285645 0.85 CDK2 (0.78) CDK2CDK4CCNA2PLK1CDK9
SCHEMBL6363137 0.85 CDK2 (0.78) CDK2CDK4CCNA2PLK1CDK9
SCHEMBL2288706 0.85 CDK2 (0.78) CDK2CDK4CCNA2PLK1CDK9
SCHEMBL6157175 0.85 CDK2 (0.78) CDK2CDK4CCNA2PLK1CDK9
SCHEMBL2287386 0.83 CDK2 (0.58) CDK2CDK4CCNA2PLK1CDK9
SCHEMBL2289774 0.83 CDK2 (0.58) CDK2CDK4CCNA2PLK1CDK9

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 CDK2 2065/4885CDK4 776/4885CCNA2 2012/4885
US-20110195968-A1 THIAZOLES AS FUNGICIDES CYP4X1, CYP4Z1, CYP3A4 CDK2 2144/4885CDK4 818/4885CCNA2 1963/4885

“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.