SCHEMBL27463427

SCHEMBL27463427

Cc1cc(C(C)C(=O)OC(C)(C)C)ccc1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.42
▸ USP30 Q70CQ3 1/20 0.39
▸ AAK1 Q2M2I8 2/20 0.37
▸ MT-CO2 P00403 1/20 0.33
▸ BACE1 P56817 1/20 0.33
▸ BACE2 Q9Y5Z0 1/20 0.33
▸ PRMT5 O14744 1/20 0.33
▸ WDR77 Q9BQA1 1/20 0.33
▸ UCHL1 P09936 1/20 0.31
▸ AKR1C3 P42330 1/20 0.30
▸ AKR1C2 P52895 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ ABCB1 P08183 4/20 0.30

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
SCHEMBL1679372 0.86 MT-CO2 (0.46) MT-CO2UCHL1AKR1C3AKR1C2TDP1
SCHEMBL1679568 0.82 AKR1C3 (0.44) AKR1C3AKR1C2
SCHEMBL20752378 0.80 AAK1 (0.40) USP30AAK1PRMT5WDR77UCHL1
SCHEMBL28817169 0.80 AAK1 (0.42) USP30AAK1PRMT5WDR77
SCHEMBL4161409 0.77 GABRA1 (0.38) USP30AAK1BACE1BACE2PRMT5
SCHEMBL2128253 0.75 MT-CO2 (0.40) APPAAK1MT-CO2UCHL1TDP1
SCHEMBL28817172 0.75 CYP1A2 (0.34) USP30UCHL1
SCHEMBL27463423 0.74 APP (0.50) APPMT-CO2AKR1C3AKR1C2TDP1
SCHEMBL15031655 0.74 LPL (0.34) AAK1
SCHEMBL12072363 0.74 CA12 (0.49) AAK1PRMT5WDR77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4622970-A1 INHIBITORS OF RIPK2 AND MEDICAL USES THEREOF ODYSSEY THERAPEUTICS, INC. (US) 2025-10-01 — — EP disclosed
WO-2024112854-A1 INHIBITORS OF RIPK2 AND MEDICAL USES THEREOF ODYSSEY THERAPEUTICS, INC. (US) 2024-05-30 — — WO disclosed
WO-2024112854-A1 INHIBITORS OF RIPK2 AND MEDICAL USES THEREOF ODYSSEY THERAPEUTICS, INC. (US) 2024-05-30 — — WO disclosed
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