SCHEMBL7683215

SCHEMBL7683215

CCCNC(=O)c1nc(C)ccc1C(=O)Nc1csc(C)c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.38
POLB P06746 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
RAB9A P51151 3/20 0.37
LMNA P02545 1/20 0.36
TDP1 Q9NUW8 2/20 0.35
NPC1 O15118 2/20 0.35
ERCC1 P07992 1/20 0.35
FEN1 P39748 1/20 0.35
ERCC4 Q92889 1/20 0.35
L3MBTL1 Q9Y468 3/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
THRB P10828 1/20 0.34
RECQL P46063 1/20 0.34
CCNE1 P24864 2/20 0.34
CDK2 P24941 2/20 0.34
HPGD P15428 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
SCHEMBL7675185 0.83 CA12 (0.42) ALDH1A1MAPTPOLBRAB9ALMNA
SCHEMBL7683202 0.78 ALDH1A1 (0.57) GAAALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL7681327 0.77 EPHX1 (0.58) GAAALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL7677603 0.74 ALDH1A1 (0.42) GAAALDH1A1MAPTPOLBSMN1; SMN2
SCHEMBL7683185 0.72 ALDH1A1 (0.41) GAAALDH1A1MAPTPOLBSMN1; SMN2
SCHEMBL7679306 0.72 ALDH1A1 (0.40) GAAALDH1A1MAPTPOLBSMN1; SMN2
SCHEMBL7676323 0.72 PDE4A (0.39) ALDH1A1MAPTPOLBSMN1; SMN2RAB9A
SCHEMBL7684169 0.71 ALDH1A1 (0.37) GAAALDH1A1POLBSMN1; SMN2RAB9A
SCHEMBL6735881 0.70 POLB (0.38) GAAALDH1A1POLBSMN1; SMN2RAB9A
SCHEMBL7680123 0.68 THRB (0.38) GAAALDH1A1MAPTPOLBSMN1; SMN2

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-6472349-B1 Pyridine-2,3-dicarboxylic acid diamides BASF AKTIENGESELLSCHAFT (DE) 2002-10-29 US disclosed