SCHEMBL7977812

SCHEMBL7977812

O=C(S)Nc1ccc2c(n1)NC(=O)CO2

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 7/20 0.41
SYK P43405 1/20 0.39
ALDH1A1 P00352 5/20 0.38
MAPT P10636 3/20 0.38
PKM P14618 1/20 0.38
NR3C1 P04150 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 2/20 0.37
MMP12 P39900 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL21400918 0.87 NR3C2 (0.42) NR3C2SYKALDH1A1MAPTPKM
SCHEMBL19250511 0.86 NR3C2 (0.44) NR3C2SYKALDH1A1MAPTNR3C1
SCHEMBL7980639 0.84 SYK (0.44) NR3C2SYKALDH1A1MAPTNR3C1
SCHEMBL7977814 0.83 NR3C2 (0.41) NR3C2SYKALDH1A1MAPTPKM
SCHEMBL7964489 0.80 CYP1A2 (0.43) NR3C2SYKALDH1A1KMT2AMMP12
SCHEMBL7974822 0.79 SYK (0.45) NR3C2SYKALDH1A1MAPTNR3C1
SCHEMBL7977863 0.76 SYK (0.39) NR3C2SYKALDH1A1MAPTNR3C1
SCHEMBL21400859 0.74 NR3C2 (0.47) NR3C2ALDH1A1MAPTNR3C1KMT2A
SCHEMBL619718 0.74 NR3C2 (0.44) NR3C2ALDH1A1MAPTPKMNR3C1
SCHEMBL23455714 0.73 EP300 (0.42) NR3C2NR3C1

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
WO-2001030782-A2 NOVEL HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2001-05-03 WO disclosed