SCHEMBL6070677

SCHEMBL6070677

COC(=O)c1ccc2[nH]c3c(c2c1)CCC(=CO)C3=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.52
CCNB2 O95067 1/20 0.52
CDK1 P06493 1/20 0.52
CCNB1 P14635 1/20 0.52
MDH2 P40926 1/20 0.52
CCNB3 Q8WWL7 1/20 0.52
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
MAPT P10636 5/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
KDM4E B2RXH2 3/20 0.49
HSD17B10 Q99714 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
ALOX15 P16050 1/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 1/20 0.49
PLK4 O00444 1/20 0.48
DAPK3 O43293 1/20 0.48
DYRK3 O43781 1/20 0.48
JAK2 O60674 1/20 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
SCHEMBL6070668 1.00 GSK3B (0.52) GSK3BCCNB2CDK1CCNB1MDH2
SCHEMBL6070387 0.85 MAPT (0.51) GSK3BCCNB2CDK1CCNB1CCNB3
SCHEMBL6070383 0.85 MAPT (0.51) GSK3BCCNB2CDK1CCNB1CCNB3
SCHEMBL26154795 0.81 MAPT (0.56) GSK3BCCNB2CDK1CCNB1MDH2
SCHEMBL6070647 0.78 KDM4E (0.72) GSK3BCCNB2CDK1CCNB1MDH2
SCHEMBL3001918 0.77 GSK3B (0.77) GSK3BCCNB2CDK1CCNB1MDH2
SCHEMBL11082468 0.76 RAB9A (0.69) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL11082466 0.76 RAB9A (0.69) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL6070802 0.74 MEN1 (0.49) GSK3BCCNB2CDK1CCNB1MDH2
SCHEMBL11126893 0.73 MEN1 (0.52) MEN1KMT2AMAPTSMN1; SMN2KDM4E

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 GSK3B 463/4885CCNB2 1197/4885CDK1 33/4885

“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.