SCHEMBL12201410

SCHEMBL12201410

CCS(=O)(=O)c1ccc(C(=O)NC(CC2CCCCC2)C(=O)OC)c(N)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 8/20 0.41
CTSS P25774 3/20 0.40
GRN P28799 1/20 0.38
SORT1 Q99523 1/20 0.38
CNR2 P34972 2/20 0.38
DRD2 P14416 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38
SLC6A4 P31645 1/20 0.38
DRD3 P35462 1/20 0.38
HTR2B P41595 1/20 0.38
KCNH2 Q12809 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
CTSL P07711 1/20 0.37
CTSB P07858 1/20 0.37
CTSK P43235 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 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
SCHEMBL2669295 0.91 KMT2A (0.45) USP30CTSSGRNSORT1CNR2
SCHEMBL9072783 0.89 GCK (0.41) USP30CTSSGRNSORT1CNR2
SCHEMBL12201393 0.89 USP30 (0.40) USP30CTSSGRNSORT1CNR2
SCHEMBL2514653 0.81 CTSS (0.47) USP30CTSSGRNSORT1CNR2
SCHEMBL2514651 0.81 CTSS (0.47) USP30CTSSGRNSORT1CNR2
SCHEMBL9072837 0.80 GCK (0.37) USP30CTSSGRNSORT1CTSL
SCHEMBL2669226 0.77 CTSL (0.47) USP30CTSSGRNSORT1CNR2
SCHEMBL31161053 0.75 CNR2 (0.47) CTSSCNR2CTSLCTSBCTSK
SCHEMBL5170782 0.71 CA2 (0.50)
SCHEMBL2514721 0.68 ALDH1A1 (0.47) KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8034822-B2 Glucokinase activators TAKEDA SAN DIEGO, INC. (US) 2011-10-11 US disclosed
US-20070213349-A1 GLUCOKINASE ACTIVATORS TAKEDA SAN DIEGO, INC. 2007-09-13 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-20070213349-A1 GLUCOKINASE ACTIVATORS GCK, GCKR, GALK1 USP30 4005/4885CTSS 843/4885GRN 1509/4885

“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.