SCHEMBL13634203

SCHEMBL13634203

CC(C)OCCN(C)c1nc(C(=O)O)cs1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 3/20 0.35
PLA2G4A P47712 1/20 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
KDM4E B2RXH2 2/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ACHE P22303 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
TP53 P04637 1/20 0.32
GAA P10253 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL15888598 0.85 RAB9A (0.48) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL3551333 0.85 ALDH1A1 (0.41) L3MBTL1ALDH1A1PLA2G4AMMP1MMP2
Hydrochloric Acid SCHEMBL2077470 0.83 ALDH1A1 (0.40) L3MBTL1ALDH1A1PLA2G4AMMP1MMP2
SCHEMBL13634202 0.82 MEN1 (0.38) L3MBTL1ALDH1A1PLA2G4AMMP1MMP2
SCHEMBL13634355 0.81 L3MBTL1 (0.36) L3MBTL1ALDH1A1PLA2G4AMMP1MMP2
SCHEMBL15888636 0.80 L3MBTL1 (0.41) L3MBTL1ALDH1A1PLA2G4AMMP1MMP2
SCHEMBL13634208 0.80 PLA2G4A (0.46) L3MBTL1ALDH1A1PLA2G4AMMP1MMP2
SCHEMBL13162589 0.80 L3MBTL1 (0.41) L3MBTL1ALDH1A1PLA2G4AMMP1MMP2
SCHEMBL3435935 0.77 L3MBTL1 (0.37) L3MBTL1ALDH1A1PLA2G4AMMP1MMP2
SCHEMBL13634300 0.76 MEN1 (0.37) MEN1KMT2A

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