SCHEMBL23212543

SCHEMBL23212543

O=[N+]([O-])c1cnn(CC2CCCC2)c1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.52
ALDH1A1 P00352 5/20 0.47
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
GAA P10253 1/20 0.41
LMNA P02545 4/20 0.40
MAPT P10636 3/20 0.40
POLB P06746 2/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
MAPK1 P28482 1/20 0.39
NPC1 O15118 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37

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
SCHEMBL21523624 0.98 L3MBTL1 (0.54) L3MBTL1ALDH1A1KMT2AMEN1CYP2C9
SCHEMBL2519395 0.94 L3MBTL1 (0.48) L3MBTL1ALDH1A1KMT2AMEN1CYP2C9
SCHEMBL16604752 0.87 L3MBTL1 (0.44) L3MBTL1ALDH1A1KMT2AMEN1CYP2C9
SCHEMBL17607084 0.85 ALDH1A1 (0.46) L3MBTL1ALDH1A1KMT2AMEN1CYP2C9
SCHEMBL14800921 0.83 ALDH1A1 (0.43) L3MBTL1ALDH1A1KMT2AMEN1CYP2C9
SCHEMBL27229343 0.81 ALDH1A1 (0.41) L3MBTL1ALDH1A1KMT2AMEN1CYP2C9
SCHEMBL27028588 0.79 L3MBTL1 (0.45) L3MBTL1ALDH1A1KMT2AMEN1CYP2C9
SCHEMBL672209 0.78 ALDH1A1 (0.44) L3MBTL1ALDH1A1KMT2AMEN1CYP2C9
SCHEMBL25239760 0.76 ALDH1A1 (0.48) L3MBTL1ALDH1A1CYP2C9CYP2C19GAA
SCHEMBL18985766 0.75 MAPT (0.50) ALDH1A1KMT2AMEN1MAPTPOLB

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-119751439-A ATF6 modulators and uses thereof 阿尔托斯实验室公司 2025-04-04 CN disclosed
CN-115087656-B ATF6 modulators and uses thereof 阿尔托斯实验室公司 2024-12-13 CN disclosed
CN-115087656-A ATF6 modulators and uses thereof 普拉西斯生物技术有限责任公司 2022-09-20 CN disclosed
EP-4041728-A1 ATF6 MODULATORS AND USES THEREOF Praxis Biotech LLC (US) 2022-08-17 EP disclosed
WO-2021069721-A1 ATF6 MODULATORS AND USES THEREOF BLACK BELT TX LTD (GB) 2021-04-15 WO disclosed