SCHEMBL2283235

SCHEMBL2283235

CCc1nc(C(C)CC)c(-c2ccnc(Nc3ccccc3)n2)s1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 15/20 0.53
CDK4 P11802 11/20 0.53
PRKCD Q05655 2/20 0.43
ABL1 P00519 1/20 0.43
EGFR P00533 1/20 0.43
PRKCA P17252 1/20 0.43
GSK3B P49841 2/20 0.42
AURKA O14965 3/20 0.41
CDK1 P06493 3/20 0.41
CDK9 P50750 3/20 0.41
CDK7 P50613 2/20 0.41
AURKB Q96GD4 1/20 0.41
PLK1 P53350 3/20 0.41
CCNA2 P20248 2/20 0.41
JAK2 O60674 1/20 0.41
JAK3 P52333 1/20 0.41
KDR P35968 1/20 0.41
PTK2 Q05397 1/20 0.41
CAMK2D Q13557 1/20 0.40
CHEK1 O14757 1/20 0.40

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
SCHEMBL2283141 0.88 CDK2 (0.58) CDK2CDK4PRKCDABL1PRKCA
SCHEMBL2288855 0.87 CDK2 (0.53) CDK2CDK4PRKCDABL1EGFR
SCHEMBL2288666 0.86 GSK3B (0.58) CDK2CDK4EGFRGSK3BAURKA
SCHEMBL2281204 0.84 CDK2 (0.47) CDK2CDK4PRKCDABL1PRKCA
SCHEMBL2287955 0.83 CDK2 (0.42) CDK2CDK4ABL1GSK3BAURKA
SCHEMBL2282087 0.83 CDK2 (0.58) CDK2CDK4PRKCDEGFRPRKCA
SCHEMBL2283254 0.82 CDK2 (0.73) CDK2CDK4GSK3BAURKACDK1
SCHEMBL2286105 0.81 PIK3CA (0.56) CDK2CDK4ABL1GSK3BAURKA
SCHEMBL27741285 0.81 CDK2 (0.36) CDK2CDK4GSK3BAURKACDK1
SCHEMBL2286079 0.80 CDK2 (0.38) CDK2CDK4AURKACDK1CDK9

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 3 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
CN-101309586-A Thiazole compounds as fungicides BAYER CROPSCIENCE AG (DE) 2008-11-19 CN 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 776/4885PRKCD 4288/4885
US-20110195968-A1 THIAZOLES AS FUNGICIDES CYP4X1, CYP4Z1, CYP3A4 CDK2 2144/4885CDK4 818/4885PRKCD 4288/4885

“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.