SCHEMBL29210384

SCHEMBL29210384

CCOc1ncccc1C(=O)N1CCOC1=O

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.58
▸ MAPT P10636 2/20 0.56
▸ KMT2A Q03164 3/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ NPC1 O15118 2/20 0.51
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ HCRTR1 O43613 1/20 0.47
▸ HCRTR2 O43614 1/20 0.47
▸ TSHR P16473 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ PKM P14618 1/20 0.47

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
SCHEMBL29944048 0.76 ALDH1A1 (0.74) ALDH1A1MAPTKMT2AMEN1MAPK1
SCHEMBL12113209 0.72 NPC1 (0.61) ALDH1A1MAPTMAPK1NPC1L3MBTL1
SCHEMBL123523 0.72 L3MBTL1 (0.64) ALDH1A1MAPTKMT2AMEN1MAPK1
SCHEMBL4724490 0.70 L3MBTL1 (0.58) ALDH1A1MAPTMAPK1NPC1L3MBTL1
SCHEMBL4731077 0.70 NPC1 (0.59) ALDH1A1MAPTKMT2AMEN1MAPK1
SCHEMBL16453663 0.70 L3MBTL1 (0.58) ALDH1A1MAPTMAPK1NPC1L3MBTL1
SCHEMBL1313733 0.69 L3MBTL1 (0.74) ALDH1A1MAPTKMT2AMAPK1NPC1
SCHEMBL17063917 0.68 NPC1 (0.64) ALDH1A1KMT2AMEN1NPC1L3MBTL1
SCHEMBL17863855 0.68 NPC1 (0.57) ALDH1A1MAPTKMT2AMEN1MAPK1
SCHEMBL16453443 0.68 L3MBTL1 (0.56) ALDH1A1MAPTKMT2AMEN1MAPK1

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-117986245-A Detection reagent for metal alkoxide, preparation and application thereof 北京瑞博奥医药科技有限公司 2024-05-07 — — CN disclosed
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