SCHEMBL2605324

SCHEMBL2605324

CC(NC(=O)OC(C)(C)C)C12CCC(CC1)N2C

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
KMT2A Q03164 2/20 0.38
SLC6A9 P48067 1/20 0.38
CTSK P43235 6/20 0.37
CTSL P07711 2/20 0.37
CTSB P07858 1/20 0.37
ELANE P08246 1/20 0.37
CTSS P25774 3/20 0.36
CYP2D6 P10635 1/20 0.35
PREP P48147 1/20 0.35
MEN1 O00255 1/20 0.35
MAPK1 P28482 1/20 0.35
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
GFER P55789 1/20 0.34

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
SCHEMBL2605310 0.80 SLC6A9 (0.41) SLC6A9PREPTSHR
SCHEMBL2605326 0.80 SLC6A9 (0.41) SLC6A9PREPTSHR
SCHEMBL2605333 0.79 SLC6A9 (0.62) SLC6A9CTSKCTSS
SCHEMBL2605325 0.79 SLC6A9 (0.62) SLC6A9CTSKCTSS
SCHEMBL2605332 0.79 SLC6A9 (0.62) SLC6A9CTSKCTSS
SCHEMBL2605306 0.73 CHRM2 (0.36) KMT2ACTSKCTSLCTSBPREP
SCHEMBL2605336 0.73 CHRM2 (0.36) KMT2ACTSKCTSLCTSBPREP
SCHEMBL25663609 0.73 CA1 (0.46) CA1CA2CA7KMT2ACTSK
SCHEMBL2605312 0.71 CTSK (0.48) KMT2ASLC6A9CTSKCTSLCTSB
SCHEMBL15829698 0.71 CA1 (0.45) CA1CA2CA7KMT2ACTSK

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-20120094995-A1 2-AZA-BICYCLO[2.2.1]HEPTANE COMPOUNDS AND USES THEREOF ASTRAZENECA AB (SE) 2012-04-19 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-20120094995-A1 2-AZA-BICYCLO[2.2.1]HEPTANE COMPOUNDS AND USES THEREOF SLC1A2, B4GALT1, SLC6A1 CA1 1236/4885CA2 1626/4885CA7 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.