SCHEMBL2287308

SCHEMBL2287308

CCc1ncc(-c2ccnc(Nc3cccc(Cl)c3)n2)s1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 6/20 0.58
CDK4 P11802 2/20 0.58
ABL1 P00519 1/20 0.57
BCR P11274 1/20 0.57
PRKCA P17252 1/20 0.57
PRKCD Q05655 1/20 0.57
MAPT P10636 2/20 0.54
CAMK2D Q13557 5/20 0.53
CDK1 P06493 3/20 0.49
EIF2AK2 P19525 2/20 0.49
CCNT1 O60563 2/20 0.49
CCNB1 P14635 2/20 0.49
CCNA2 P20248 2/20 0.49
CDK7 P50613 2/20 0.49
CDK9 P50750 2/20 0.49
CCNH P51946 2/20 0.49
CSNK2A1 P68400 2/20 0.49
CCNA1 P78396 1/20 0.49
PIK3CA P42336 2/20 0.48
PIK3CB P42338 2/20 0.48

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
SCHEMBL2282078 0.87 CDK2 (0.58) CDK2CDK4ABL1BCRCDK1
SCHEMBL2286397 0.86 CDK2 (0.53) CDK2CDK4ABL1PRKCAPRKCD
SCHEMBL2287037 0.85 CDK2 (0.68) CDK2CDK4ABL1BCRPRKCA
SCHEMBL2284467 0.85 PIK3CG (0.64) CDK2CDK4ABL1BCRCAMK2D
SCHEMBL2284149 0.83 IKBKB (0.53) CDK2ABL1BCRPRKCAPRKCD
SCHEMBL2289026 0.83 CAMK2D (0.62) CDK2CDK4ABL1BCRPRKCA
SCHEMBL28776135 0.82 IKBKB (0.52) CDK2ABL1BCRPRKCAPRKCD
SCHEMBL27741344 0.80 PRKCA (0.60) CDK2CDK4ABL1BCRPRKCA
SCHEMBL2283676 0.79 CDK2 (0.58) CDK2CDK4ABL1BCRPRKCA
SCHEMBL2283141 0.79 CDK2 (0.58) CDK2CDK4ABL1BCRPRKCA

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 776/4885ABL1 797/4885
US-20110195968-A1 THIAZOLES AS FUNGICIDES CYP4X1, CYP4Z1, CYP3A4 CDK2 2144/4885CDK4 818/4885ABL1 732/4885

“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.