SCHEMBL2177023

SCHEMBL2177023

CC(C)(C)OC(=O)NC1CCC(Nc2cnc(C(=O)O)cn2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 1/20 0.46
SKP1 P63208 1/20 0.46
SKP2 Q13309 1/20 0.46
KDM1A O60341 1/20 0.45
MAOB P27338 1/20 0.45
HCAR3 P49019 3/20 0.44
BTK Q06187 5/20 0.41
MERTK Q12866 1/20 0.41
JAK1 P23458 3/20 0.41
JAK2 O60674 2/20 0.40
KCNA3 P22001 1/20 0.40
CTSK P43235 2/20 0.39
TYK2 P29597 1/20 0.39
JAK3 P52333 1/20 0.39
PIK3CA P42336 1/20 0.39
MTOR P42345 1/20 0.39
PRKDC P78527 1/20 0.39
PCSK9 Q8NBP7 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 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
SCHEMBL2177020 1.00 CKS1B (0.46) CKS1BSKP1SKP2KDM1AMAOB
SCHEMBL1937460 0.89 PCSK9 (0.50) CKS1BSKP1SKP2KDM1AMAOB
SCHEMBL1937464 0.89 PCSK9 (0.50) CKS1BSKP1SKP2KDM1AMAOB
SCHEMBL30238614 0.84 BTK (0.44) CKS1BSKP1SKP2KDM1AMAOB
SCHEMBL28486799 0.84 BTK (0.44) CKS1BSKP1SKP2KDM1AMAOB
SCHEMBL27261334 0.82 PCSK9 (0.54) CKS1BSKP1SKP2KDM1AMAOB
SCHEMBL27261349 0.81 BTK (0.41) CKS1BSKP1SKP2KDM1AMAOB
SCHEMBL15223282 0.80 BTK (0.47) CKS1BSKP1SKP2KDM1AMAOB
SCHEMBL15223285 0.80 BTK (0.47) CKS1BSKP1SKP2KDM1AMAOB
SCHEMBL24537960 0.79 KDM1A (0.46) CKS1BSKP1SKP2KDM1AMAOB

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-20110166161-A1 HETEROCYCLIC CARBOXAMIDE COMPOUNDS ASTELLAS PHARMA INC. (JP) 2011-07-07 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-20110166161-A1 HETEROCYCLIC CARBOXAMIDE COMPOUNDS ROCK1, ROCK2, RHOT2 CKS1B 708/4885SKP1 2653/4885SKP2 2526/4885

“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.