SCHEMBL29064672

SCHEMBL29064672

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

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TXNRD1 Q16881 4/20 0.37
GSR P00390 3/20 0.37
MAPT P10636 7/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MERTK Q12866 1/20 0.34
FGFR4 P22455 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
PKM P14618 1/20 0.34
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL16469858 0.91 MAPT (0.42) TXNRD1GSRMAPTALDH1A1MAPK1
SCHEMBL16470360 0.89 TXNRD1 (0.37) TXNRD1GSRMAPTALDH1A1MAPK1
SCHEMBL29064664 0.87 TXNRD1 (0.39) TXNRD1MAPTALDH1A1MAPK1L3MBTL1
SCHEMBL29064680 0.86 TXNRD1 (0.36) TXNRD1GSRMAPTL3MBTL1MERTK
SCHEMBL29064660 0.86 TXNRD1 (0.43) TXNRD1GSRMAPTMAPK1
SCHEMBL29064687 0.85 TXNRD1 (0.39) TXNRD1GSRMAPTMAPK1HTT
SCHEMBL29064685 0.82 TXNRD1 (0.34) TXNRD1GSRMAPTMERTKFGFR4
SCHEMBL29064665 0.81 ALDH1A1 (0.35) TXNRD1MAPTALDH1A1MAPK1L3MBTL1
SCHEMBL29064682 0.81 ALDH1A1 (0.31) TXNRD1MAPTALDH1A1MAPK1L3MBTL1
SCHEMBL16470365 0.80 MAPT (0.39) TXNRD1MAPTALDH1A1MAPK1L3MBTL1

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