SCHEMBL669215

SCHEMBL669215

N#CC1(CO)CC1CCc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.39
CTSS P25774 2/20 0.39
CTSL P07711 1/20 0.39
CTSB P07858 1/20 0.39
CTSC P53634 1/20 0.39
TDP1 Q9NUW8 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
BRCA1 P38398 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
CUL4A Q13619 1/20 0.37
HSD17B10 Q99714 1/20 0.37
SLC1A2 P43004 1/20 0.36

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
SCHEMBL668935 0.75 SLC1A2 (0.42) CTSKCTSSCTSLCTSBCTSC
SCHEMBL10073905 0.74 CTSS (0.41) CTSKCTSSCTSLCTSBCTSC
SCHEMBL10084270 0.71 CTSK (0.38) CTSKCTSSCTSLCTSBCTSC
SCHEMBL668888 0.70 KDM1A (0.51)
SCHEMBL10073881 0.70 CTSS (0.41) CTSKCTSSCTSLCTSBCTSC
SCHEMBL8049074 0.66 CTSK (0.44) CTSKCTSSCTSLCTSBCTSC
SCHEMBL2440927 0.65 LMNA (0.43) ALDH1A1
SCHEMBL8049453 0.64 SLC6A2 (0.41) CTSKCTSSCTSLCTSBCTSC
Hydrocinnamyl Alcohol SCHEMBL27600091 0.60 TDP1 (0.58) TDP1SMN1; SMN2MAPTALOX15TSHR
Phenylethyl Alcohol SCHEMBL28192302 0.60 TDP1 (0.73) TDP1SMN1; SMN2ALDH1A1HPGDALOX15

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 3 patents. 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
US-20120046455-A1 Catalytic Cyclopropanation of Alkenes with Alpha-Cyano-Diazoacetates NATIONAL SCIENCE FOUNDATION 2012-02-23 US disclosed
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 1162/4885CTSS 843/4885CTSL 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.