SCHEMBL20853010

SCHEMBL20853010

Cc1cc(N)c2[nH]c(=O)[nH]c(=O)c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYMP P19971 2/20 0.39
PARP1 P09874 7/20 0.39
HSD17B10 Q99714 3/20 0.36
GRIN2D O15399 2/20 0.36
GRIN3B O60391 2/20 0.36
GRIN1 Q05586 2/20 0.36
GRIN2A Q12879 2/20 0.36
GRIN2B Q13224 2/20 0.36
GRIN2C Q14957 2/20 0.36
GRIN3A Q8TCU5 2/20 0.36
KDM4E B2RXH2 5/20 0.36
ALDH1A1 P00352 4/20 0.36
HPGD P15428 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GAA P10253 3/20 0.36
MAPT P10636 2/20 0.36
CYP1A2 P05177 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
GLA P06280 2/20 0.35
HTT P42858 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
SCHEMBL8807640 0.81 HSD17B10 (0.52) TYMPPARP1HSD17B10GRIN2DGRIN3B
SCHEMBL6201771 0.81 PARP1 (0.39) TYMPPARP1KDM4EALDH1A1HPGD
SCHEMBL26316432 0.78 PARP1 (0.39) TYMPPARP1HSD17B10GRIN2DGRIN3B
SCHEMBL17883940 0.78 ALDH1A1 (0.49) TYMPPARP1HSD17B10GRIN2DGRIN3B
SCHEMBL23991764 0.76 HCAR2 (0.39) TYMPPARP1HSD17B10GRIN2DGRIN3B
SCHEMBL16940088 0.75 ALDH1A1 (0.38) TYMPPARP1HSD17B10GRIN2DGRIN3B
SCHEMBL14227433 0.75 HCAR2 (0.41) TYMPPARP1HSD17B10GRIN2DGRIN3B
SCHEMBL20885947 0.73 PARP1 (0.35) TYMPPARP1HSD17B10GRIN2DGRIN3B
SCHEMBL6390771 0.73 TYMP (0.38) TYMPPARP1HSD17B10GRIN2DGRIN3B
SCHEMBL22699207 0.71 PARP1 (0.46) TYMPPARP1HSD17B10KDM4EALDH1A1

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-2019059973-A1 EXON SKIPPING OLIGOMER CONJUGATES FOR MUSCULAR DYSTROPHY SAREPTA THERAPEUTICS, INC. (US) 2019-03-28 WO disclosed