SCHEMBL6070802

SCHEMBL6070802

COC(=O)c1ccc2[nH]c3c(c2c1)CCc1c[nH]nc1-3

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
GSK3B P49841 2/20 0.48
CCNB2 O95067 1/20 0.48
CDK1 P06493 1/20 0.48
CCNB1 P14635 1/20 0.48
MDH2 P40926 1/20 0.48
CCNB3 Q8WWL7 1/20 0.48
MAPKAPK2 P49137 1/20 0.47
KDM4E B2RXH2 2/20 0.46
HSD17B10 Q99714 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
MAPT P10636 2/20 0.46
ALOX15 P16050 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.45
PLK4 O00444 1/20 0.45
DAPK3 O43293 1/20 0.45
DYRK3 O43781 1/20 0.45

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
SCHEMBL6070994 0.91 KIF11 (0.50) MEN1KMT2AGSK3BCCNB2CDK1
SCHEMBL6071266 0.88 KDM4E (0.62) MEN1KMT2AGSK3BCCNB2CDK1
SCHEMBL6070734 0.87 GSK3B (0.47) KMT2AGSK3BCCNB2CDK1CCNB1
SCHEMBL6070686 0.80 MAPK10 (0.62) MEN1KMT2AGSK3BKDM4EHSD17B10
SCHEMBL6071270 0.79 PRKD1 (0.47) MEN1KMT2AGSK3BKDM4EHSD17B10
SCHEMBL14731537 0.79 CCNB2 (0.44) MEN1KMT2AGSK3BCCNB2CDK1
SCHEMBL6071199 0.79 AURKA (0.53) MEN1KMT2AGSK3BCCNB2CDK1
SCHEMBL6070880 0.78 MPL (0.57) GSK3BMAPK8CDK5DYRK1APARP1
SCHEMBL6070722 0.77 MAPK10 (0.59) MEN1KMT2AGSK3BCCNB2CDK1
SCHEMBL14731467 0.77 CCNB2 (0.42) MEN1KMT2AGSK3BCCNB2CDK1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060264493-A1 Tetracyclic pyrazole derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2006-11-23 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 (1 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-20060264493-A1 Tetracyclic pyrazole derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them MAP3K1, MAP3K19, MAP3K20 MEN1 2523/4885KMT2A 2104/4885GSK3B 463/4885

“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.