SCHEMBL30064858

SCHEMBL30064858

O=C(O)N1CC[C@H](O)C1CO

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ GBA1 P04062 14/20 0.38
▸ GBA2 Q9HCG7 2/20 0.36
▸ POLB P06746 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL21292661 1.00 GAA (0.41) GAATHRBGBA1GBA2POLB
SCHEMBL3317512 1.00 GAA (0.41) GAATHRBGBA1GBA2POLB
SCHEMBL16279687 1.00 GAA (0.41) GAATHRBGBA1GBA2POLB
SCHEMBL25237187 0.88 POLB (0.46) GAATHRBGBA1GBA2POLB
SCHEMBL3360203 0.82 GBA1 (0.42) GAATHRBGBA1GBA2
SCHEMBL16277708 0.82 PLG (0.32) —
SCHEMBL13942058 0.82 GBA1 (0.42) GAATHRBGBA1GBA2
SCHEMBL15186923 0.82 GBA1 (0.42) GAATHRBGBA1GBA2
SCHEMBL3360199 0.82 GBA1 (0.42) GAATHRBGBA1GBA2
SCHEMBL13032050 0.79 GBA1 (0.42) GAATHRBGBA1GBA2

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
EP-4087573-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2022-11-16 — — EP disclosed
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