SCHEMBL13634208

SCHEMBL13634208

CCCN(C)c1nc(C(=O)O)cs1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLA2G4A P47712 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.41
HCAR3 P49019 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
MMP13 P45452 1/20 0.39
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ACHE P22303 1/20 0.36
DHODH Q02127 1/20 0.36
POLB P06746 1/20 0.34

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
SCHEMBL15888636 0.87 L3MBTL1 (0.41) PLA2G4AL3MBTL1ALDH1A1MMP1MMP2
SCHEMBL13162589 0.87 L3MBTL1 (0.41) PLA2G4AL3MBTL1ALDH1A1MMP1MMP2
SCHEMBL13634202 0.84 MEN1 (0.38) PLA2G4AL3MBTL1ALDH1A1MMP1MMP2
SCHEMBL3551333 0.83 ALDH1A1 (0.41) PLA2G4AL3MBTL1ALDH1A1MMP1MMP2
SCHEMBL13163971 0.82 L3MBTL1 (0.38) PLA2G4AL3MBTL1ALDH1A1MMP1MMP2
Hydrochloric Acid SCHEMBL2077470 0.82 ALDH1A1 (0.40) PLA2G4AL3MBTL1ALDH1A1MMP1MMP2
SCHEMBL13634355 0.80 L3MBTL1 (0.36) PLA2G4AL3MBTL1ALDH1A1MMP1MMP2
SCHEMBL13634203 0.80 L3MBTL1 (0.36) PLA2G4AL3MBTL1ALDH1A1MMP1MMP2
SCHEMBL13270554 0.79 L3MBTL1 (0.41) PLA2G4AL3MBTL1ALDH1A1MMP1MMP2
SCHEMBL13162587 0.79 L3MBTL1 (0.41) PLA2G4AL3MBTL1ALDH1A1MMP1MMP2

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 1 patent. 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