SCHEMBL2176090

SCHEMBL2176090

Cn1cc(S(=O)(=O)Cl)c2cc(OCc3ccccc3)ccc21

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
KMT2A Q03164 2/20 0.53
MAOB P27338 3/20 0.49
HTR6 P50406 1/20 0.47
AS3MT Q9HBK9 1/20 0.46
SRD5A2 P31213 1/20 0.46
HRH3 Q9Y5N1 2/20 0.45
MAOA P21397 1/20 0.43
DYRK1A Q13627 1/20 0.42
PKM P14618 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PPARG P37231 1/20 0.42
PPARD Q03181 1/20 0.42
PPARA Q07869 1/20 0.42
LTB4R Q15722 1/20 0.41
LTB4R2 Q9NPC1 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
SCHEMBL2175788 0.90 DYRK1A (0.47) MEN1NPC1RAB9AKMT2AMAOB
SCHEMBL2176044 0.88 MEN1 (0.53) MEN1NPC1RAB9AKMT2AMAOB
SCHEMBL2175615 0.78 CA12 (0.50) MEN1NPC1RAB9AKMT2AMAOB
SCHEMBL4328766 0.78 MEN1 (0.61) MEN1NPC1RAB9AKMT2AMAOB
SCHEMBL7387644 0.76 SRD5A2 (0.50) MEN1NPC1RAB9AKMT2AMAOB
SCHEMBL28375660 0.75 GRM5 (0.48) MEN1NPC1RAB9AKMT2AMAOB
SCHEMBL28326780 0.75 KMT2A (0.52) MEN1NPC1RAB9AKMT2AMAOB
SCHEMBL28995408 0.75 SRD5A2 (0.51) MEN1NPC1RAB9AKMT2AMAOB
SCHEMBL21614278 0.74 CYP4F2 (0.51) MEN1NPC1RAB9AKMT2AMAOB
SCHEMBL2176450 0.74 MAPT (0.43) NPC1RAB9AHTR6L3MBTL1

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 MEN1 1402/4885NPC1 2662/4885RAB9A 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.