2-Picolinic Acid

2-Picolinic Acid

SCHEMBL29135065

NC(=O)c1cccc(S(=O)(=O)N2CCCc3ccccc32)c1.O=C(O)c1ccccn1

nearest known ligand 0.70

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 2/20 0.70
AKR1C1 Q04828 1/20 0.62
GAA P10253 1/20 0.59
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
LMNA P02545 4/20 0.54
HTT P42858 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
L3MBTL1 Q9Y468 3/20 0.54
ALDH1A1 P00352 3/20 0.54
MAPK1 P28482 1/20 0.54
STAT3 P40763 1/20 0.53
CASP3 P42574 1/20 0.53
SENP8 Q96LD8 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
ATM Q13315 1/20 0.53
NR3C1 P04150 1/20 0.51
AR P10275 1/20 0.51
KDM4E B2RXH2 1/20 0.51

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
Benzoic Acid SCHEMBL29134718 0.89 AKR1C3 (0.84) AKR1C3AKR1C1GAAMEN1KMT2A
SCHEMBL29135079 0.84 AKR1C3 (0.72) AKR1C3AKR1C1GAAMEN1KMT2A
SCHEMBL664241 0.84 AKR1C3 (1.00) AKR1C3AKR1C1GAAMEN1KMT2A
SCHEMBL30679105 0.84 AKR1C3 (1.00) AKR1C3AKR1C1GAAMEN1KMT2A
SCHEMBL29135072 0.83 AKR1C3 (0.74) AKR1C3AKR1C1GAAMEN1KMT2A
Thiophene Carboxylic Acid SCHEMBL29135074 0.81 AKR1C3 (0.70) AKR1C3AKR1C1GAAMEN1KMT2A
SCHEMBL29134721 0.81 AKR1C3 (0.70) AKR1C3AKR1C1GAAMEN1KMT2A
SCHEMBL663840 0.78 AKR1C3 (1.00) AKR1C3AKR1C1GAAMEN1KMT2A
SCHEMBL30788245 0.76 AKR1C3 (0.66) AKR1C3AKR1C1GAAMEN1KMT2A
SCHEMBL27179876 0.76 AKR1C3 (0.66) AKR1C3AKR1C1GAAMEN1KMT2A

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-117298108-A Androgen receptor and glucocorticoid receptor dual-target inhibitor and application thereof 浙江师范大学 2023-12-29 CN disclosed