SCHEMBL26088703

SCHEMBL26088703

COC(=O)NCCOCCOCC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ EPHX1 P07099 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ LMNA P02545 2/20 0.41
▸ EPHX2 P34913 2/20 0.39
▸ HSP90AA1 P07900 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ GLP1R P43220 8/20 0.37
▸ ACHE P22303 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL9340071 0.85 EPHX1 (0.52) MEN1KMT2AEPHX1SMN1; SMN2LMNA
SCHEMBL29721054 0.85 MEN1 (0.44) MEN1KMT2AEPHX1SMN1; SMN2LMNA
SCHEMBL24340304 0.85 MEN1 (0.44) MEN1KMT2AEPHX1SMN1; SMN2LMNA
SCHEMBL29240391 0.85 MEN1 (0.44) MEN1KMT2AEPHX1SMN1; SMN2LMNA
SCHEMBL30864659 0.82 MEN1 (0.46) MEN1KMT2ASMN1; SMN2EPHX2CYP2C19
SCHEMBL13699512 0.82 MEN1 (0.49) MEN1KMT2AEPHX1ALDH1A1
SCHEMBL21071644 0.82 MEN1 (0.49) MEN1KMT2AEPHX1ALDH1A1
SCHEMBL21069640 0.82 MEN1 (0.49) MEN1KMT2AEPHX1ALDH1A1
SCHEMBL23728812 0.82 MEN1 (0.49) MEN1KMT2AEPHX1ALDH1A1
SCHEMBL1261192 0.82 MEN1 (0.49) MEN1KMT2AEPHX1ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4419540-A1 IMMUNOMODULATORS Bristol-Myers Squibb Company (US) 2024-08-28 — — EP disclosed
WO-2023069994-A1 IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-04-27 — — WO disclosed
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