SCHEMBL1490852

SCHEMBL1490852

CCCNC(=O)c1cccc([C](CC)NS(C)(=O)=O)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.56
ALDH1A1 P00352 3/20 0.52
POLB P06746 1/20 0.52
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 4/20 0.46
MEN1 O00255 1/20 0.46
KDM4E B2RXH2 2/20 0.46
ERN1 O75460 1/20 0.45
NAMPT P43490 1/20 0.45
ROCK2 O75116 1/20 0.44
GAA P10253 3/20 0.43
HSD17B10 Q99714 2/20 0.43
HPGD P15428 1/20 0.41
LMNA P02545 1/20 0.41
ALOX15 P16050 1/20 0.41
MAPK1 P28482 1/20 0.41
NAAA Q02083 1/20 0.41
HDAC3 O15379 1/20 0.41

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
SCHEMBL13763531 0.82 L3MBTL1 (0.80) L3MBTL1SMN1; SMN2ALDH1A1POLBNPC1
SCHEMBL1490804 0.81 NPSR1 (0.48) SMN1; SMN2ALDH1A1KMT2AKDM4EERN1
SCHEMBL6358306 0.77 ALDH1A1 (0.66) L3MBTL1SMN1; SMN2ALDH1A1POLBNPC1
SCHEMBL5123030 0.76 L3MBTL1 (0.71) L3MBTL1SMN1; SMN2ALDH1A1POLBNPC1
SCHEMBL163436 0.76 L3MBTL1 (0.71) L3MBTL1SMN1; SMN2ALDH1A1POLBNPC1
SCHEMBL6027923 0.76 L3MBTL1 (0.71) L3MBTL1SMN1; SMN2ALDH1A1POLBNPC1
SCHEMBL2964483 0.75 L3MBTL1 (0.69) L3MBTL1SMN1; SMN2ALDH1A1POLBNPC1
SCHEMBL1490874 0.74 ALDH1A1 (0.60) SMN1; SMN2ALDH1A1POLBHPGD
SCHEMBL10790383 0.74 L3MBTL1 (0.67) L3MBTL1SMN1; SMN2ALDH1A1POLBNPC1
SCHEMBL1753828 0.73 L3MBTL1 (0.71) L3MBTL1SMN1; SMN2ALDH1A1POLBNPC1

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-7897609-B2 Aryl substituted imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-03-01 US disclosed