SCHEMBL18700229

SCHEMBL18700229

CC1CC(=O)N(c2ccc(Cc3ccc(N4C(=O)CC(C(C)C)C4=O)cc3)cc2)C1=O

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 8/20 0.41
MAPT P10636 7/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPK1 P28482 3/20 0.39
LMNA P02545 3/20 0.38
RAB9A P51151 1/20 0.38
FAAH O00519 1/20 0.38
MGLL Q99685 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
KCNH2 Q12809 1/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL16675655 0.93 GAA (0.48) GAAL3MBTL1ALDH1A1MAPTLMNA
SCHEMBL16681934 0.89 ALDH1A1 (0.47) GAAL3MBTL1ALDH1A1MAPTTDP1
SCHEMBL16675654 0.86 MGLL (0.57) GAAL3MBTL1ALDH1A1TDP1LMNA
SCHEMBL16118177 0.83 ALDH1A1 (0.50) GAAL3MBTL1ALDH1A1MAPTTDP1
SCHEMBL14159540 0.82 MGLL (0.62) GAAALDH1A1MAPTTDP1MAPK1
SCHEMBL14750419 0.81 MGLL (0.50) GAAL3MBTL1ALDH1A1MAPTLMNA
SCHEMBL18466208 0.79 ALDH1A1 (0.50) GAAL3MBTL1ALDH1A1MAPTTDP1
SCHEMBL16566170 0.79 ALDH1A1 (0.50) GAAL3MBTL1ALDH1A1MAPTTDP1
SCHEMBL16118178 0.78 GAA (0.49) GAAL3MBTL1ALDH1A1LMNARAB9A
SCHEMBL15370241 0.78 LMNA (0.43) ALDH1A1MAPTTDP1LMNARAB9A

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-9611359-B2 Maleimide-terminated sulfur-containing polymers, compositions thereof, and uses thereof PRC-DESOTO INTERNATIONAL, INC. (US) 2017-04-04 US disclosed