SCHEMBL31035124

SCHEMBL31035124

NNC(=O)c1cccc(N)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.66
ALDH1A1 P00352 2/20 0.66
SMN1; SMN2 Q16637 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
HSD17B10 Q99714 1/20 0.57
PBRM1 Q86U86 1/20 0.57
AOC2 O75106 1/20 0.56
KDM4C Q9H3R0 1/20 0.56
PTGS1 P23219 2/20 0.53
MEN1 O00255 1/20 0.50
MAPT P10636 1/20 0.50
KMT2A Q03164 1/20 0.50
HDAC1 Q13547 1/20 0.49
NPC1 O15118 1/20 0.49
MITF O75030 1/20 0.49
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.49
F2 P00734 1/20 0.48
PLG P00747 1/20 0.48
PRSS1 P07477 1/20 0.48

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
SCHEMBL294944 1.00 KDM4E (0.66) KDM4EALDH1A1SMN1; SMN2NPSR1HSD17B10
SCHEMBL77384 0.87 ALDH1A1 (0.76) KDM4EALDH1A1SMN1; SMN2HSD17B10AOC2
SCHEMBL9921285 0.85 SMN1; SMN2 (0.59) KDM4EALDH1A1SMN1; SMN2NPSR1HSD17B10
SCHEMBL10630944 0.84 ALDH1A1 (0.57) KDM4EALDH1A1SMN1; SMN2NPSR1HSD17B10
SCHEMBL6159659 0.83 KDM4E (0.62) KDM4EALDH1A1SMN1; SMN2NPSR1HSD17B10
SCHEMBL1904111 0.83 ALDH1A1 (0.70) KDM4EALDH1A1SMN1; SMN2HSD17B10AOC2
SCHEMBL13168478 0.82 SMN1; SMN2 (0.56) KDM4EALDH1A1SMN1; SMN2NPSR1HSD17B10
SCHEMBL3055037 0.82 ALDH1A1 (0.63) KDM4EALDH1A1SMN1; SMN2AOC2MEN1
SCHEMBL21424259 0.82 SMN1; SMN2 (0.56) KDM4EALDH1A1SMN1; SMN2NPSR1HSD17B10
SCHEMBL520073 0.82 HDAC8 (0.63) KDM4EALDH1A1SMN1; SMN2NPSR1HSD17B10

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
CN-221426455-U Portable reagent tube capable of detecting trace bleeding 南充市第四人民医院 2024-07-26 CN disclosed