SCHEMBL10073885

SCHEMBL10073885

CC1CC1(C#N)C(=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 4/20 0.33
MAPK1 P28482 2/20 0.33
CTSL P07711 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
CTSS P25774 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
SCHEMBL669465 0.82 CTSK (0.32) CTSKCTSL
SCHEMBL669757 0.81 CTSK (0.34) CTSKCTSLMEN1KMT2AALDH1A1
SCHEMBL668943 0.80 CTSK (0.30) CTSK
SCHEMBL10073876 0.78
SCHEMBL10073882 0.78 MEN1 (0.31) MAPK1MEN1KMT2A
SCHEMBL10073864 0.78 CTSK (0.32) CTSKMAPK1CTSLMEN1KMT2A
SCHEMBL670221 0.78
SCHEMBL15203382 0.78 CTSK (0.31) CTSK
SCHEMBL16865150 0.77
SCHEMBL14479561 0.77 HSD11B1 (0.33) CTSKMAPK1MEN1KMT2AALDH1A1

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-20120046455-A1 Catalytic Cyclopropanation of Alkenes with Alpha-Cyano-Diazoacetates NATIONAL SCIENCE FOUNDATION 2012-02-23 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-20120046455-A1 Catalytic Cyclopropanation of Alkenes with Alpha-Cyano-Diazoacetates PPOX, POR, PCCA CTSK 1162/4885MAPK1 2618/4885CTSL 1469/4885

“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.