SCHEMBL29064664

SCHEMBL29064664

CCN(Cc1cnc(C)s1)c1nc(N(C)C)ccc1[N+](=O)[O-]

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TXNRD1 Q16881 4/20 0.39
MAPT P10636 2/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ALDH3A1 P30838 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL16470355 0.89 TXNRD1 (0.39) TXNRD1MAPTALDH1A1MAPK1L3MBTL1
SCHEMBL16470365 0.89 MAPT (0.39) TXNRD1MAPTALDH1A1MAPK1L3MBTL1
SCHEMBL29064667 0.88 TXNRD1 (0.41) TXNRD1MAPTPOLB
SCHEMBL29064672 0.87 TXNRD1 (0.37) TXNRD1MAPTALDH1A1MAPK1L3MBTL1
SCHEMBL29064660 0.84 TXNRD1 (0.43) TXNRD1MAPTMAPK1
SCHEMBL29064682 0.82 ALDH1A1 (0.31) TXNRD1MAPTALDH1A1MAPK1L3MBTL1
SCHEMBL29064665 0.80 ALDH1A1 (0.35) TXNRD1MAPTALDH1A1MAPK1L3MBTL1
SCHEMBL29064687 0.79 TXNRD1 (0.39) TXNRD1MAPTMAPK1
SCHEMBL16469858 0.77 MAPT (0.42) TXNRD1MAPTALDH1A1MAPK1L3MBTL1
SCHEMBL16470287 0.76 MAPT (0.41) TXNRD1MAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116265460-B Thiazole methyl pyridine amine compound and preparation method and application thereof 湖南化工研究院有限公司 2025-03-14 CN claimed
CN-116265460-A Thiazole methyl pyridine amine compound and preparation method and application thereof 湖南化工研究院有限公司 2023-06-20 CN claimed
CN-116265460-B Thiazole methyl pyridine amine compound and preparation method and application thereof 湖南化工研究院有限公司 2025-03-14 CN disclosed
CN-116265460-A Thiazole methyl pyridine amine compound and preparation method and application thereof 湖南化工研究院有限公司 2023-06-20 CN disclosed