SCHEMBL2279007

SCHEMBL2279007

COCC(C)Nc1nc(C2CC2)c(-c2ccnc(Nc3cc(OC)ccc3OC)n2)s1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MKNK2 Q9HBH9 16/20 0.49
FLT3 P36888 9/20 0.49
MKNK1 Q9BUB5 7/20 0.49
CCNT1 O60563 2/20 0.42
CDK1 P06493 2/20 0.42
CCNB1 P14635 2/20 0.42
CCNA2 P20248 2/20 0.42
CDK2 P24941 2/20 0.42
CDK7 P50613 2/20 0.42
CDK9 P50750 2/20 0.42
CCNH P51946 2/20 0.42
CCNA1 P78396 2/20 0.42
IGF1R P08069 1/20 0.39
KCNH2 Q12809 1/20 0.38

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
SCHEMBL2283277 0.87 MKNK2 (0.53) MKNK2FLT3MKNK1CCNT1CDK1
SCHEMBL2282373 0.86 CDK2 (0.53) MKNK2FLT3CCNT1CDK1CCNB1
SCHEMBL2281255 0.85 CDK2 (0.54) MKNK2FLT3CCNT1CDK1CCNB1
SCHEMBL2285846 0.84 MKNK2 (0.50) MKNK2FLT3MKNK1CDK1CDK2
SCHEMBL2287258 0.82 MKNK2 (0.55) MKNK2FLT3MKNK1CDK1CDK2
SCHEMBL2287133 0.82 MKNK2 (0.51) MKNK2FLT3MKNK1CCNT1CDK1
SCHEMBL2285772 0.82 CDK2 (0.52) CCNT1CDK1CCNB1CCNA2CDK2
SCHEMBL2281907 0.82 MKNK2 (0.52) MKNK2FLT3MKNK1IGF1RKCNH2
SCHEMBL2286458 0.82 MKNK2 (0.48) MKNK2FLT3MKNK1
SCHEMBL2283318 0.82 MKNK2 (0.52) MKNK2FLT3MKNK1CCNT1CDK1

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.