SCHEMBL2176709

SCHEMBL2176709

CC(C)c1nc(N)sc1I

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.35
SCN4A P35499 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NOS1 P29475 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
SCHEMBL18898666 0.76 SMN1; SMN2 (0.37) NPC1SCN4ARAB9ASMN1; SMN2NOS1
SCHEMBL6258086 0.74 NOS1 (0.52) NPC1SCN4ARAB9ASMN1; SMN2NOS1
SCHEMBL10986635 0.74 FBP1 (0.37) NPC1SCN4ARAB9ASMN1; SMN2NOS1
SCHEMBL20346770 0.73 SMN1; SMN2 (0.35) NPC1SCN4ARAB9ASMN1; SMN2NOS1
SCHEMBL21737735 0.73
SCHEMBL14803850 0.73 SMN1; SMN2 (0.35) NPC1SCN4ARAB9ASMN1; SMN2NOS1
SCHEMBL404505 0.73 MEN1 (0.37) NPC1SCN4ARAB9ASMN1; SMN2NOS1
SCHEMBL28216048 0.70 CYP1A2 (0.38) NPC1SCN4ARAB9ASMN1; SMN2NOS1
SCHEMBL19059552 0.70
SCHEMBL27459038 0.68 FBP1 (0.40) NPC1SCN4ARAB9ASMN1; SMN2NOS1

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-7973051-B2 Aminothiazoles as FBPase inhibitors for diabetes HOFFMAN-LA ROCHE INC. (US) 2011-07-05 US disclosed
CN-101878211-A Aminothiazole derivs HOFFMANN LA ROCHE 2010-11-03 CN 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 (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-20090143448-A1 NEW AMINOTHIAZOLES AS FBPASE INHIBITORS FOR DIABETES FBP1, SLC5A1, DPP4 NPC1 2662/4885SCN4A 3216/4885RAB9A 2410/4885

“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.