SCHEMBL2176450

SCHEMBL2176450

Cn1cc(S(=O)(=O)Cl)c2cccc(OCc3ccccc3)c21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
MAPK1 P28482 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ADORA3 P0DMS8 2/20 0.42
ADORA2A P29274 1/20 0.41
ADORA1 P30542 1/20 0.41
FBP1 P09467 2/20 0.40
BRD4 O60885 3/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HTR6 P50406 1/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
LIPE Q05469 1/20 0.38
HTR3A P46098 1/20 0.37
MAPK14 Q16539 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL2174841 0.88 ADORA3 (0.44) MAPTL3MBTL1MAPK1TDP1ADORA3
SCHEMBL2087148 0.81 FBP1 (0.43) MAPK1TDP1FBP1BRD4SMN1; SMN2
SCHEMBL2088849 0.80 FBP1 (0.47) MAPTFBP1BRD4HTR6CNR2
SCHEMBL2088864 0.77 FBP1 (0.40) MAPK1TDP1FBP1SMN1; SMN2HTR6
SCHEMBL2174640 0.77 FBP1 (0.44) L3MBTL1TDP1FBP1SMN1; SMN2HTR6
SCHEMBL1093358 0.77 ALDH1A1 (0.47) MAPTL3MBTL1MAPK1TDP1ADORA3
SCHEMBL2175689 0.76 KDM4E (0.44) MAPTMAPK1FBP1NPC1RAB9A
SCHEMBL27815525 0.75 SLC22A6 (0.41) MAPTL3MBTL1MAPK1TDP1FBP1
SCHEMBL1500952 0.75 MAPT (0.50) MAPTL3MBTL1MAPK1TDP1BRD4
SCHEMBL2175788 0.74 DYRK1A (0.47) TDP1NPC1RAB9AHTR6

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 MAPT 1274/4885L3MBTL1 3174/4885MAPK1 1234/4885

“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.