SCHEMBL11328396

SCHEMBL11328396

NC(=O)c1c(N)cccc1[N+](=O)[O-]

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
GPR35 Q9HC97 2/20 0.48
PDE7A Q13946 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TSHR P16473 3/20 0.43
PLAU P00749 1/20 0.43
LMNA P02545 2/20 0.42
CTSD P07339 1/20 0.42
MAPK1 P28482 1/20 0.41
ALDH1A1 P00352 3/20 0.41
POLB P06746 2/20 0.41
PARP1 P09874 1/20 0.41
KDM4E B2RXH2 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL6807284 0.88 GPR35 (0.61) TDP1L3MBTL1GPR35SMN1; SMN2TSHR
SCHEMBL283612 0.85 TDP1 (0.64) TDP1L3MBTL1GPR35PDE7ASMN1; SMN2
SCHEMBL11833211 0.84 GPR35 (0.47) TDP1L3MBTL1GPR35PDE7ASMN1; SMN2
SCHEMBL8477874 0.84 TDP1 (0.53) TDP1L3MBTL1GPR35PDE7ASMN1; SMN2
Hydrochloric Acid SCHEMBL11180501 0.84 TDP1 (0.62) TDP1L3MBTL1GPR35PDE7ASMN1; SMN2
SCHEMBL1315874 0.81 TDP1 (0.50) TDP1L3MBTL1GPR35TSHRPLAU
SCHEMBL2892615 0.81 GPR35 (0.56) TDP1L3MBTL1GPR35TSHRPLAU
SCHEMBL11854765 0.81 MAPK1 (0.60) TDP1L3MBTL1GPR35PDE7ASMN1; SMN2
SCHEMBL28311212 0.80 L3MBTL1 (0.43) TDP1L3MBTL1GPR35PDE7ASMN1; SMN2
SCHEMBL793981 0.80 TDP1 (0.49) TDP1L3MBTL1GPR35SMN1; SMN2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121779265-A Preparation method of 2-amino-6-nitrobenzamide 浙江工业大学 2026-04-03 CN disclosed
CN-121779265-A Preparation method of 2-amino-6-nitrobenzamide 浙江工业大学 2026-04-03 CN disclosed
CN-115572282-B Pyrazole amide compound containing aromatic heterocyclic structure, and preparation method and application thereof 华东理工大学 2024-07-09 CN disclosed
CN-115572282-A Pyrazole amide compound containing aromatic heterocyclic structure, and preparation method and application thereof 华东理工大学 2023-01-06 CN disclosed
US-4307113-A TREATMENT OF DIABETES SANDOZ, INC. (US) 1981-12-22 US disclosed