SCHEMBL3202282

SCHEMBL3202282

COC(CN(C(=O)Nc1ncc(SCC(=O)O)s1)C1CCC(C)CC1)C1CC1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 16/20 0.38
▸ CCNE2 O96020 10/20 0.38
▸ CCNE1 P24864 10/20 0.38
▸ CDK1 P06493 7/20 0.38
▸ CCNB1 P14635 7/20 0.38
▸ CCNB2 O95067 6/20 0.38
▸ CDK4 P11802 6/20 0.38
▸ CCND1 P24385 6/20 0.38
▸ CCNB3 Q8WWL7 6/20 0.38
▸ GCK P35557 2/20 0.34
▸ ITK Q08881 1/20 0.33
▸ CDK9 P50750 6/20 0.32
▸ CCNT1 O60563 1/20 0.32
▸ CDK7 P50613 1/20 0.32
▸ CCNH P51946 1/20 0.32
▸ ADORA2A P29274 1/20 0.32
▸ ADORA1 P30542 1/20 0.32

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
SCHEMBL3202275 1.00 CDK2 (0.38) CDK2CCNE2CCNE1CDK1CCNB1
SCHEMBL1482941 0.85 CDK2 (0.36) CDK2CCNE2CCNE1CDK1CCNB1
SCHEMBL1240783 0.84 CDK2 (0.38) CDK2CCNE2CCNE1CDK1CCNB1
SCHEMBL1238529 0.84 CDK2 (0.38) CDK2CCNE2CCNE1CDK1CCNB1
SCHEMBL1238524 0.84 CDK2 (0.38) CDK2CCNE2CCNE1CDK1CCNB1
SCHEMBL1240824 0.83 CDK2 (0.38) CDK2CCNE2CCNE1CDK1CCNB1
SCHEMBL1241316 0.82 CCNE1 (0.40) CDK2CCNE2CCNE1CDK1CCNB1
SCHEMBL1241338 0.82 CDK2 (0.37) CDK2CCNE2CCNE1CDK1CCNB1
SCHEMBL2606465 0.81 CDK2 (0.43) CDK2CCNE2CCNE1CDK1CCNB1
SCHEMBL1240409 0.81 CDK2 (0.41) CDK2CCNE2CCNE1CDK1CCNB1

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-8318778-B2 Urea glucokinase activators NOVO NORDISK A/S (DK) 2012-11-27 — — US disclosed
US-20100041711-A1 Urea Glucokinase Activators NOVO NORDISK A/S (DK) 2010-02-18 — — 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-20100041711-A1 Urea Glucokinase Activators GCK, GCKR, HK2 CDK2 381/4885CCNE2 2292/4885CCNE1 3375/4885

“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.

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