SCHEMBL22440457

SCHEMBL22440457

COC[C@H]1CN[C@@H](CO)C1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 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
SCHEMBL21522310 1.00 GBA1 (0.30) GBA1
SCHEMBL21807459 1.00 GBA1 (0.30) GBA1
SCHEMBL27930257 0.85 — —
SCHEMBL23043729 0.83 ALOX5 (0.30) —
SCHEMBL16143068 0.80 — —
SCHEMBL5321773 0.80 — —
SCHEMBL9975335 0.78 — —
SCHEMBL13660714 0.78 — —
SCHEMBL1584880 0.78 — —
SCHEMBL22631357 0.77 — —

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-3710439-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2020-09-23 — — EP disclosed
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