SCHEMBL13634202

SCHEMBL13634202

CCOCCN(C)c1nc(C(=O)O)cs1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
PLA2G4A P47712 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 4/20 0.35
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
MMP13 P45452 1/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
RARA P10276 1/20 0.33
RARB P10826 1/20 0.33
RARG P13631 1/20 0.33
ACHE P22303 1/20 0.33

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
SCHEMBL3551333 0.86 ALDH1A1 (0.41) MEN1KMT2APLA2G4AL3MBTL1ALDH1A1
Hydrochloric Acid SCHEMBL2077470 0.84 ALDH1A1 (0.40) MEN1KMT2APLA2G4AL3MBTL1ALDH1A1
SCHEMBL13634208 0.84 PLA2G4A (0.46) MEN1KMT2APLA2G4AL3MBTL1ALDH1A1
SCHEMBL13634355 0.82 L3MBTL1 (0.36) MEN1KMT2APLA2G4AL3MBTL1ALDH1A1
SCHEMBL13634203 0.82 L3MBTL1 (0.36) MEN1KMT2APLA2G4AL3MBTL1ALDH1A1
SCHEMBL13162589 0.81 L3MBTL1 (0.41) MEN1KMT2APLA2G4AL3MBTL1ALDH1A1
SCHEMBL15888636 0.81 L3MBTL1 (0.41) PLA2G4AL3MBTL1ALDH1A1MMP1MMP2
SCHEMBL13634299 0.77 MEN1 (0.41) MEN1KMT2A
SCHEMBL9911158 0.77 MEN1 (0.33) MEN1KMT2A
SCHEMBL13162587 0.77 L3MBTL1 (0.41) MEN1KMT2APLA2G4AL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2206707-B1 AZOLECARBOXAMIDE COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC (JP) 2014-07-23 EP disclosed
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed