SCHEMBL30890473

SCHEMBL30890473

NC(=O)[C@@H]1C[C@]2(CN1)Oc1ccccc1CNC2=O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ AURKA O14965 1/20 0.32
▸ BACE1 P56817 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ AKR1C3 P42330 1/20 0.30
▸ AKR1C2 P52895 1/20 0.30
▸ AKR1C1 Q04828 1/20 0.30
▸ ATM Q13315 1/20 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
SCHEMBL27245225 1.00 GAA (0.33) GAANPSR1AURKABACE1ALDH1A1
Trifluoroacetic Acid SCHEMBL27244936 0.92 KDM1A (0.32) —
SCHEMBL27245180 0.89 GAA (0.35) GAANPSR1BACE1ALDH1A1AKR1C3
SCHEMBL30890427 0.85 BACE1 (0.48) GAANPSR1BACE1ALDH1A1
SCHEMBL27245043 0.82 BACE1 (0.39) GAABACE1ALDH1A1ATM
SCHEMBL27244746 0.82 NPC1 (0.35) —
Hydrochloric Acid SCHEMBL27245163 0.81 BACE1 (0.39) BACE1ALDH1A1
SCHEMBL30890499 0.75 BACE1 (0.47) AURKABACE1
SCHEMBL27244719 0.75 BACE1 (0.47) AURKABACE1
SCHEMBL27244855 0.74 PTK2B (0.32) GAANPSR1ALDH1A1AKR1C3AKR1C2

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-4612156-A1 ANTI-VIRAL COMPOUNDS Aligos Therapeutics, Inc. (US) 2025-09-10 — — EP disclosed
WO-2024097296-A1 ANTI-VIRAL COMPOUNDS ALIGOS THERAPEUTICS, INC. (US) 2024-05-10 — — WO disclosed
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