SCHEMBL2283307

SCHEMBL2283307

CC(=O)Nc1ccc(Nc2nccc(-c3sc(N4CCOC4=O)nc3C)n2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 7/20 0.52
CDK2 P24941 14/20 0.52
CDK4 P11802 13/20 0.52
AURKA O14965 11/20 0.52
AURKB Q96GD4 10/20 0.52
CDK9 P50750 10/20 0.52
CDK7 P50613 7/20 0.52
CDK1 P06493 7/20 0.52
WEE1 P30291 3/20 0.52
JAK3 P52333 3/20 0.52
CHEK1 O14757 2/20 0.52
DAPK3 O43293 2/20 0.52
PRKD3 O94806 2/20 0.52
MAP4K4 O95819 2/20 0.52
PAK4 O96013 2/20 0.52
ABL1 P00519 2/20 0.52
LCK P06239 2/20 0.52
FYN P06241 2/20 0.52
CSF1R P07333 2/20 0.52
RET P07949 2/20 0.52

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
SCHEMBL2286279 0.91 CDK2 (0.51) JAK2CDK2CDK4AURKAAURKB
SCHEMBL2288421 0.90 CDK2 (0.61) JAK2CDK2CDK4AURKAAURKB
SCHEMBL2281073 0.88 CDK2 (0.61) JAK2CDK2CDK4AURKAAURKB
SCHEMBL2286217 0.88 CDK2 (0.59) JAK2CDK2CDK4AURKAAURKB
SCHEMBL2286403 0.85 JAK2 (0.52) JAK2CDK2CDK4AURKAAURKB
SCHEMBL2289260 0.84 CDK2 (0.57) JAK2CDK2CDK4AURKAAURKB
SCHEMBL2282825 0.83 CDK2 (0.49) JAK2CDK2CDK4AURKAAURKB
SCHEMBL2279493 0.83 CDK2 (0.63) JAK2CDK2CDK4AURKAAURKB
SCHEMBL2285621 0.82 CDK2 (0.48) JAK2CDK2CDK4AURKAAURKB
SCHEMBL2282996 0.82 CDK2 (0.48) JAK2CDK2CDK4AURKAAURKB

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 JAK2 1056/4885CDK2 2065/4885CDK4 776/4885
US-20110195968-A1 THIAZOLES AS FUNGICIDES CYP4X1, CYP4Z1, CYP3A4 JAK2 985/4885CDK2 2144/4885CDK4 818/4885

“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.