SCHEMBL5197191

SCHEMBL5197191

CC(C)(C)OC(=O)c1sc(-c2ccccc2)nc1N

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 6/20 0.52
DBF4 Q9UBU7 6/20 0.52
TRPM8 Q7Z2W7 3/20 0.51
GRM6 O15303 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
ALDH1A1 P00352 2/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HPGDS O60760 1/20 0.45
CCNE1 P24864 1/20 0.43
CDK2 P24941 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
NPC1 O15118 1/20 0.42
PAX8 Q06710 1/20 0.42
ALOX5 P09917 1/20 0.42
LHCGR P22888 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
SCHEMBL16312760 0.84 SMN1; SMN2 (0.66) CDC7DBF4TRPM8SMN1; SMN2ALDH1A1
SCHEMBL1726531 0.84 TRPM8 (0.71) CDC7DBF4TRPM8GRM6SMN1; SMN2
SCHEMBL27935666 0.81 CDC7 (0.78) CDC7DBF4TRPM8SMN1; SMN2ALDH1A1
SCHEMBL7759391 0.77 NPC1 (0.70) SMN1; SMN2MAPTHPGDCDK2NPC1
SCHEMBL2481891 0.76 L3MBTL1 (0.49) CDC7DBF4TRPM8GRM6SMN1; SMN2
SCHEMBL27891114 0.75 GRM6 (0.56) GRM6SMN1; SMN2ALDH1A1GAAMAPT
SCHEMBL28861577 0.74 LMNA (0.42) CDC7DBF4GRM6SMN1; SMN2ALDH1A1
SCHEMBL5193754 0.74 TRPM8 (0.53) TRPM8SMN1; SMN2ALDH1A1GAAMAPT
SCHEMBL7264963 0.73 GRM6 (0.51) GRM6SMN1; SMN2ALDH1A1GAAMAPT
SCHEMBL5193911 0.73 RAB9A (0.42) CDC7DBF4TRPM8SMN1; SMN2ALDH1A1

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
EP-1321463-B1 Thiazole derivatives and their use for the treatment or prevention of Flavivirus infections VIROCHEM PHARMA INC (CA) 2007-08-08 EP disclosed
EP-1321463-B1 Thiazole derivatives and their use for the treatment or prevention of Flavivirus infections VIROCHEM PHARMA INC (CA) 2007-08-08 EP disclosed
US-6936629-B2 Compounds and methods for the treatment or prevention of flavivirus infections VIROCHEM PHARMA INC. (CA) 2005-08-30 US disclosed
US-20030199503-A1 Compounds and methods for the treatment of prevention of flavivirus infections SHIRE BIOCHEM INC. (CA) 2003-10-23 US disclosed
EP-1321463-A1 Thiazole derivatives and their use for the treatment or prevention of Flavivirus infections Shire Biochem Inc. (CA) 2003-06-25 EP 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-20030199503-A1 Compounds and methods for the treatment of prevention of flavivirus infections HAVCR2, ZC3HAV1, EIF2AK2 CDC7 4724/4885DBF4 2982/4885TRPM8 2212/4885

“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.