SCHEMBL29034856

SCHEMBL29034856

CC(C)NC=O.NC(=O)c1cc2c(cn1)[nH]c1ccccc12

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.58
MEN1 O00255 2/20 0.58
APOBEC3G Q9HC16 1/20 0.58
GABRA1 P14867 13/20 0.58
GABRG2 P18507 13/20 0.58
GABRB3 P28472 13/20 0.58
GABRA5 P31644 13/20 0.58
GABRA3 P34903 13/20 0.58
GABRA2 P47869 13/20 0.58
GABRA6 Q16445 9/20 0.58
GABRA4 P48169 8/20 0.58
GABRP O00591 6/20 0.58
GABRD O14764 6/20 0.58
GABRB1 P18505 6/20 0.58
GABRB2 P47870 6/20 0.58
GABRE P78334 6/20 0.58
GABRG1 Q8N1C3 6/20 0.58
GABRG3 Q99928 6/20 0.58
GABRQ Q9UN88 6/20 0.58
KDM4E B2RXH2 3/20 0.58

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
SCHEMBL30480076 0.85 GABRP (0.75) KMT2AMEN1APOBEC3GGABRA1GABRG2
SCHEMBL1180609 0.85 GABRP (0.75) KMT2AMEN1APOBEC3GGABRA1GABRG2
SCHEMBL966651 0.85 GABRP (0.75) KMT2AMEN1APOBEC3GGABRA1GABRG2
SCHEMBL29034852 0.84 GABRA1 (0.60) KMT2AMEN1APOBEC3GGABRA1GABRG2
Formanilide SCHEMBL29034862 0.83 GABRA1 (0.61) KMT2AMEN1APOBEC3GGABRA1GABRG2
SCHEMBL29034835 0.82 GABRA1 (0.61) KMT2AMEN1APOBEC3GGABRA1GABRG2
SCHEMBL29034867 0.80 GABRA1 (0.57) KMT2AMEN1GABRA1GABRG2GABRB3
SCHEMBL29034823 0.79 GABRA1 (0.53) KMT2AMEN1APOBEC3GGABRA1GABRG2
SCHEMBL29034873 0.79 GABRP (0.56) KMT2AMEN1APOBEC3GGABRA1GABRG2
SCHEMBL29034874 0.79 GABRP (0.56) KMT2AMEN1GABRA1GABRG2GABRB3

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-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