SCHEMBL2174374

SCHEMBL2174374

CCc1sc(NC(=O)OC(C)(C)C)nc1C

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LCK P06239 9/20 0.52
PI4KB Q9UBF8 1/20 0.50
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
ALDH1A1 P00352 1/20 0.44
FBP1 P09467 1/20 0.42
TSHR P16473 1/20 0.41
PSEN1 P49768 1/20 0.41
PSEN2 P49810 1/20 0.41
APH1B Q8WW43 1/20 0.41
NCSTN Q92542 1/20 0.41
APH1A Q96BI3 1/20 0.41
PSENEN Q9NZ42 1/20 0.41

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
SCHEMBL539354 0.88 PI4KB (0.53) LCKPI4KBCA1CA2ALDH1A1
SCHEMBL539642 0.87 LCK (0.52) LCKPI4KBCA1CA2ALDH1A1
SCHEMBL7496332 0.83 LCK (0.48) LCKPI4KBCA1CA2ALDH1A1
SCHEMBL24434742 0.82 CA1 (0.42) LCKPI4KBCA1CA2ALDH1A1
SCHEMBL24434747 0.82 L3MBTL1 (0.47) LCKPI4KBCA1CA2ALDH1A1
SCHEMBL13326568 0.81 LCK (0.56) LCKPI4KBCA1CA2
SCHEMBL9529240 0.81 CA1 (0.41) LCKPI4KBCA1CA2ALDH1A1
SCHEMBL4257610 0.81 CA1 (0.41) LCKPI4KBCA1CA2ALDH1A1
SCHEMBL13609513 0.80 TSHR (0.41) LCKPI4KBCA1CA2ALDH1A1
SCHEMBL13609514 0.79 LCK (0.40) LCKPI4KBCA1CA2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230150956-A1 MYC INHIBITORS AND USES THEREOF STEMSYNERGY THERAPEUTICS, INC. 2023-05-18 US disclosed
US-7973051-B2 Aminothiazoles as FBPase inhibitors for diabetes HOFFMAN-LA ROCHE INC. (US) 2011-07-05 US disclosed
EP-2227468-A1 AMINOTHIAZOLE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2010-09-15 EP disclosed
US-20090143448-A1 NEW AMINOTHIAZOLES AS FBPASE INHIBITORS FOR DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2009-06-04 US disclosed
WO-2009068467-A1 AMINOTHIAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-06-04 WO 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 (2 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-20230150956-A1 MYC INHIBITORS AND USES THEREOF MYC, AURKA, AURKC LCK 856/4885PI4KB 148/4885CA1 4533/4885
US-20090143448-A1 NEW AMINOTHIAZOLES AS FBPASE INHIBITORS FOR DIABETES FBP1, SLC5A1, DPP4 LCK 3717/4885PI4KB 2383/4885CA1 3718/4885

“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.