SCHEMBL30899283

SCHEMBL30899283

Cc1ccc(-c2nnc(-c3ccccc3)[nH]2)cc1S(=O)(=O)C1CCC2(CCNCC2)O1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.36
BRD4 O60885 5/20 0.35
BRD2 P25440 5/20 0.35
BRD3 Q15059 5/20 0.35
NSD3 Q9BZ95 1/20 0.32
POLB P06746 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31

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
SCHEMBL30899302 0.86 BRD4 (0.36) MAOBBRD4BRD2BRD3NSD3
SCHEMBL30899281 0.84 MAOB (0.35) MAOBBRD4BRD2BRD3NSD3
SCHEMBL30899303 0.77 MAOB (0.33) MAOBBRD4BRD2BRD3
SCHEMBL24512243 0.72 CNR1 (0.41) MAOBBRD4BRD2BRD3POLB
SCHEMBL29717158 0.72 CNR1 (0.41) MAOBBRD4BRD2BRD3POLB
SCHEMBL30899307 0.70 MAOB (0.35) MAOBBRD4BRD2BRD3POLB
SCHEMBL24512121 0.69 CNR1 (0.46) MAOBBRD4BRD2BRD3L3MBTL1
SCHEMBL24512359 0.69 CNR1 (0.46) MAOBBRD4BRD2BRD3L3MBTL1
SCHEMBL24512231 0.69 BRD4 (0.47) BRD4BRD2BRD3
SCHEMBL24512219 0.69 CNR1 (0.48) BRD4BRD2BRD3L3MBTL1CNR1

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-117915903-A Compounds for the treatment of neurodegenerative, degenerative and metabolic disorders and uses thereof 佛罗里达大学研究基金会公司 2024-04-19 CN disclosed