SCHEMBL11666352

SCHEMBL11666352

NC(=O)c1cc(O)c(C(N)=O)cc1N

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.43
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 4/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 2/20 0.43
TSHR P16473 1/20 0.43
IKBKB O14920 2/20 0.42
CHUK O15111 1/20 0.40
CYP3A4 P08684 2/20 0.39
GAA P10253 2/20 0.39
ESR2 Q92731 1/20 0.39
PTPN1 P18031 1/20 0.39
GRK6 P43250 1/20 0.38
TDP1 Q9NUW8 2/20 0.36
POLB P06746 1/20 0.36
PPM1B O75688 1/20 0.36
MKNK1 Q9BUB5 1/20 0.36
MKNK2 Q9HBH9 1/20 0.36
BRD4 O60885 1/20 0.36
MEN1 O00255 2/20 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
SCHEMBL9673157 0.88 KDM4E (0.44) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL23511720 0.87 ALDH1A1 (0.52) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL5847055 0.87 IKBKB (0.50) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL6209540 0.86 MAPT (0.43) MAPTKDM4EALDH1A1HPGDHSD17B10
Water SCHEMBL28292285 0.85 ALDH1A1 (0.50) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL11052232 0.82 ALDH1A1 (0.48) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL17774896 0.80 DGAT1 (0.41) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL28569941 0.78 ALDH1A1 (0.50) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL5847061 0.78 IDO1 (0.54) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL17779181 0.76 ALDH1A1 (0.54) MAPTKDM4EALDH1A1HPGDHSD17B10

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-4087409-A USED TO SPIN FIBERS MONSANTO COMPANY (US) 1978-05-02 US disclosed