SCHEMBL29057423

SCHEMBL29057423

Nc1ncc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)s1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ OGA O60502 10/20 0.72
▸ ATM Q13315 1/20 0.59
▸ MAPT P10636 2/20 0.52
▸ HTT P42858 2/20 0.51
▸ ALDH1A1 P00352 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ LMNA P02545 1/20 0.50
▸ FPR2 P25090 1/20 0.50
▸ CA1 P00915 1/20 0.49
▸ CA2 P00918 1/20 0.49
▸ CA7 P43166 1/20 0.49
▸ KCNA5 P22460 1/20 0.49
▸ DRD2 P14416 1/20 0.49

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
SCHEMBL29057489 0.91 OGA (0.64) OGAATMALDH1A1MEN1KMT2A
SCHEMBL29057507 0.90 OGA (0.66) OGAHTTALDH1A1KMT2ACA1
SCHEMBL29057479 0.89 OGA (0.72) OGAATMMAPTHTTALDH1A1
SCHEMBL29057543 0.89 OGA (0.71) OGAATMALDH1A1MEN1KMT2A
SCHEMBL29057449 0.88 OGA (0.61) OGAATMMAPTALDH1A1MEN1
SCHEMBL29057450 0.85 OGA (0.77) OGAATMMAPTALDH1A1KCNA5
SCHEMBL29057446 0.85 OGA (0.77) OGAATMMAPTALDH1A1KCNA5
SCHEMBL29057480 0.85 OGA (0.77) OGAATMMAPTALDH1A1KCNA5
SCHEMBL29057447 0.85 OGA (0.74) OGAATMALDH1A1MEN1KMT2A
SCHEMBL27022312 0.84 OGA (1.00) OGA

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-116438167-A Compounds having O-GlcNAc enzyme inhibitory activity and uses thereof 美迪福伦DBT有限公司 2023-07-14 — — CN disclosed
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