SCHEMBL1709291

SCHEMBL1709291

CCC(=O)[C@@H](CC)COC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.41
CA2 P00918 5/20 0.34
CA1 P00915 3/20 0.34
USP2 O75604 1/20 0.31
TSHR P16473 1/20 0.31
GRN P28799 1/20 0.30
SORT1 Q99523 1/20 0.30

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
SCHEMBL25846983 0.81 CA2 (0.48) MAPK1CA2CA1GRNSORT1
SCHEMBL16508843 0.78 CA2 (0.55) MAPK1CA2CA1USP2TSHR
SCHEMBL1709280 0.75 MAPK1 (0.41) MAPK1GRNSORT1
SCHEMBL5372259 0.74
SCHEMBL1709290 0.72 CYP2D6 (0.39) MAPK1CA2CA1
SCHEMBL14374875 0.71 MAPK1 (0.38) MAPK1GRNSORT1
SCHEMBL14224894 0.68 MAPK1 (0.35) MAPK1GRNSORT1
SCHEMBL19183173 0.68 MEN1 (0.46) CA2CA1
SCHEMBL30022963 0.68 MAPK1 (0.43) MAPK1CA2GRNSORT1
SCHEMBL13632327 0.68 MAPK1 (0.39) MAPK1

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-20120088770-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PRISM BIOLAB CORPORATION (JP) 2012-04-12 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-20120088770-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PLOD3, COL1A1, THPO MAPK1 2497/4885CA2 4015/4885CA1 3499/4885

“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.