SCHEMBL13634355

SCHEMBL13634355

CN(CCOC(C)(C)C)c1nc(C(=O)O)cs1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 4/20 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
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ACHE P22303 1/20 0.32
KDM4E B2RXH2 2/20 0.32
GAA P10253 2/20 0.32
TP53 P04637 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GSTO1 P78417 1/20 0.31
POLB P06746 1/20 0.30

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
SCHEMBL15888545 0.85 RAB9A (0.48) ALDH1A1MEN1KMT2AKDM4EGAA
SCHEMBL3551333 0.85 ALDH1A1 (0.41) L3MBTL1ALDH1A1PLA2G4AMMP1MMP2
Hydrochloric Acid SCHEMBL2077470 0.83 ALDH1A1 (0.40) L3MBTL1ALDH1A1PLA2G4AMMP1MMP2
SCHEMBL13634202 0.82 MEN1 (0.38) L3MBTL1ALDH1A1PLA2G4AMMP1MMP2
SCHEMBL13634203 0.81 L3MBTL1 (0.36) L3MBTL1ALDH1A1PLA2G4AMMP1MMP2
SCHEMBL13634208 0.80 PLA2G4A (0.46) L3MBTL1ALDH1A1PLA2G4AMMP1MMP2
SCHEMBL15888636 0.80 L3MBTL1 (0.41) L3MBTL1ALDH1A1PLA2G4AMMP1MMP2
SCHEMBL13162589 0.80 L3MBTL1 (0.41) L3MBTL1ALDH1A1PLA2G4AMMP1MMP2
SCHEMBL24035929 0.76 ALDH1A1 (0.45) L3MBTL1ALDH1A1PLA2G4AMMP1MMP2
SCHEMBL13634340 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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