SCHEMBL8559008

SCHEMBL8559008

CCN(CC)c1nc(C(=O)O)c(C(=O)O)cc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 4/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
HSD17B10 Q99714 2/20 0.37
ALOX15 P16050 2/20 0.37
SLC16A3 O15427 1/20 0.37
SLC16A1 P53985 1/20 0.37
HTT P42858 2/20 0.36
TP53 P04637 1/20 0.36
GLA P06280 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CRHR1 P34998 2/20 0.34
GAA P10253 1/20 0.34
LMNA P02545 1/20 0.34
HMGB1 P09429 1/20 0.33
CXCL12 P48061 1/20 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
SCHEMBL8323264 0.77 ALOX15 (0.47) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL8658096 0.73 KDM4E (0.41) TDP1KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL6644480 0.70 GABRP (0.44) TDP1KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL1187870 0.69 HCAR3 (0.43) TDP1KDM4EALDH1A1HSD17B10ALOX15
Hydrochloric Acid SCHEMBL1188178 0.68 HCAR3 (0.42) TDP1KDM4EALDH1A1HSD17B10ALOX15
SCHEMBL258457 0.68 ALDH1A1 (0.43) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL23459716 0.67 KDM4E (0.41) KDM4EALDH1A1HPGDHSD17B10ALOX15
SCHEMBL9315436 0.67 SMN1; SMN2 (0.50) TDP1KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL11495872 0.67 ALDH1A1 (0.67) TDP1KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL11655924 0.66 ALDH1A1 (0.49) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10

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
EP-0663399-B1 Pyridine-2,3-dicarboxylic imides, process for their preparation and their use to control the growth of unwanted plants BASF AG (DE) 1998-06-10 EP claimed