SCHEMBL13634187

SCHEMBL13634187

CCc1csc(N2CCCC2=O)n1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.66
ALDH1A1 P00352 3/20 0.40
NPC1 O15118 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
PKM P14618 2/20 0.40
KDM4E B2RXH2 1/20 0.40
RAB9A P51151 1/20 0.40
TP53 P04637 2/20 0.36
OGA O60502 1/20 0.36
USP2 O75604 1/20 0.35
CTSB P07858 1/20 0.35
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MAPK1 P28482 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
TSHR P16473 1/20 0.34
PDE10A Q9Y233 1/20 0.34
HPGD P15428 2/20 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
SCHEMBL3544311 0.80 L3MBTL1 (1.00) L3MBTL1ALDH1A1NPC1SMN1; SMN2PKM
SCHEMBL12402370 0.76 L3MBTL1 (0.67) L3MBTL1ALDH1A1NPC1SMN1; SMN2PKM
SCHEMBL29135323 0.76 L3MBTL1 (0.67) L3MBTL1ALDH1A1NPC1SMN1; SMN2PKM
SCHEMBL2077603 0.74 L3MBTL1 (0.59) L3MBTL1ALDH1A1NPC1SMN1; SMN2PKM
SCHEMBL3435748 0.74 L3MBTL1 (0.56) L3MBTL1ALDH1A1NPC1SMN1; SMN2PKM
SCHEMBL10279631 0.74 OGA (0.48) SMN1; SMN2RAB9ATP53OGACTSB
SCHEMBL3550329 0.73 L3MBTL1 (0.61) L3MBTL1ALDH1A1NPC1SMN1; SMN2PKM
SCHEMBL15269069 0.72 L3MBTL1 (0.60) L3MBTL1ALDH1A1NPC1SMN1; SMN2PKM
SCHEMBL22136195 0.71 PARP1 (0.58) L3MBTL1ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL13162278 0.71 L3MBTL1 (0.58) L3MBTL1ALDH1A1NPC1SMN1; SMN2PKM

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