SCHEMBL28890744

SCHEMBL28890744

CC(NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)c1cccc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.51
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL25155836 0.87
SCHEMBL29494522 0.87
SCHEMBL1321466 0.87
SCHEMBL29494539 0.82 MEN1 (0.53) MEN1KMT2A
SCHEMBL28404707 0.82 MEN1 (0.53) MEN1KMT2A
SCHEMBL29793667 0.82 MEN1 (0.53) MEN1KMT2A
SCHEMBL28257375 0.82 LMNA (0.61) ALDH1A1MEN1KMT2A
SCHEMBL10527020 0.82 NPC1 (0.55) MEN1KMT2A
SCHEMBL10527016 0.82 NPC1 (0.55) MEN1KMT2A
SCHEMBL7932004 0.82 MEN1 (0.51) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108929263-B Arylamide Kv2.1 inhibitor and preparation method, pharmaceutical composition and application thereof 中国医学科学院药物研究所 2022-07-22 CN disclosed
CN-111108092-A Arylamide Kv2.1 inhibitor and preparation method, pharmaceutical composition and application thereof 中国医学科学院药物研究所 2020-05-05 CN disclosed