SCHEMBL28429347

SCHEMBL28429347

NC(=O)c1cc2c([nH]c3ccccc32)c(C(N)=O)n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 4/20 0.52
LMNA P02545 2/20 0.51
KDM4E B2RXH2 2/20 0.51
MAPT P10636 2/20 0.51
ALDH1A1 P00352 1/20 0.51
TP53 P04637 1/20 0.51
HPGD P15428 1/20 0.51
MAPK1 P28482 1/20 0.51
HSD17B10 Q99714 1/20 0.51
KMT2A Q03164 5/20 0.51
MEN1 O00255 4/20 0.51
GABRP O00591 2/20 0.48
GABRD O14764 2/20 0.48
GABRA1 P14867 2/20 0.48
GABRB1 P18505 2/20 0.48
GABRG2 P18507 2/20 0.48
GABRB3 P28472 2/20 0.48
GABRA5 P31644 2/20 0.48
GABRA3 P34903 2/20 0.48
GABRA2 P47869 2/20 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
SCHEMBL29424954 0.92 KMT2A (0.52) STAT3LMNAKDM4EMAPTALDH1A1
SCHEMBL21724817 0.92 KMT2A (0.52) STAT3LMNAKDM4EMAPTALDH1A1
SCHEMBL29034855 0.92 DYRK1A (0.55) STAT3LMNAKDM4EMAPTALDH1A1
Stellarines A SCHEMBL31291576 0.90 STAT3 (0.64) STAT3LMNAKDM4EMAPTALDH1A1
Stellarines A SCHEMBL28437753 0.90 STAT3 (0.64) STAT3LMNAKDM4EMAPTALDH1A1
SCHEMBL28432889 0.87 STAT3 (0.57) STAT3LMNAKDM4EMAPTALDH1A1
SCHEMBL29425002 0.87 STAT3 (0.49) STAT3LMNAKDM4EMAPTALDH1A1
SCHEMBL21724980 0.87 MAPT (0.71) STAT3LMNAKDM4EMAPTALDH1A1
SCHEMBL29424976 0.87 MAPT (0.71) STAT3LMNAKDM4EMAPTALDH1A1
SCHEMBL6246419 0.85 LMNA (0.51) STAT3LMNAKDM4EMAPTALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116396291-A Application of 1-amide and 1-hydrazide substituted beta-carboline derivative as agricultural bactericide 南京农业大学 2023-07-07 CN disclosed
CN-111303148-B 1-substituted beta-carboline derivatives and application thereof 南京农业大学 2022-08-30 CN disclosed
CN-111303148-A 1-substituted β -carboline derivatives and application thereof 南京农业大学 2020-06-19 CN disclosed