SCHEMBL23057265

SCHEMBL23057265

[O-][S+](Nc1ccccc1N1CCCCC1)c1ccc(Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ KCNQ2 O43526 5/20 0.48
▸ MAPT P10636 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.44
▸ MCOLN3 Q8TDD5 2/20 0.41
▸ CSF1R P07333 1/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ PKM P14618 1/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ PIM1 P11309 1/20 0.39
▸ PIM3 Q86V86 1/20 0.39

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
SCHEMBL23057209 0.88 L3MBTL1 (0.45) MEN1KMT2AKCNQ2MAPTLMNA
SCHEMBL23057084 0.86 L3MBTL1 (0.43) MEN1KMT2AKCNQ2MAPTLMNA
SCHEMBL23057203 0.86 MAPK1 (0.45) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL23057136 0.86 KEAP1 (0.41) MEN1KMT2AKCNQ2MAPTLMNA
SCHEMBL23057120 0.86 MEN1 (0.53) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL23057051 0.86 L3MBTL1 (0.43) MEN1KMT2AKCNQ2MAPTALDH1A1
SCHEMBL23057240 0.83 L3MBTL1 (0.40) MEN1KMT2AKCNQ2MAPTALDH1A1
SCHEMBL23057155 0.83 L3MBTL1 (0.40) MEN1KMT2AKCNQ2MAPTALDH1A1
SCHEMBL23057174 0.83 L3MBTL1 (0.41) MEN1KMT2AKCNQ2MAPTLMNA
SCHEMBL23057216 0.83 L3MBTL1 (0.40) MEN1KMT2AKCNQ2MAPTALDH1A1

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
WO-2021041866-A1 SMALL MOLECULE AGONISTS OF MUCOLIPIN 1 AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2021-03-04 — — WO disclosed
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