SCHEMBL29624397

SCHEMBL29624397

CC(C)(C)OC(=O)[C@H]1NC[C@H]2[C@@H]1C2(C)C

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.35
RECQL P46063 1/20 0.31

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
SCHEMBL31375005 0.83 MAPK1 (0.33) MAPK1
SCHEMBL685097 0.79 CHRNB2 (0.37)
SCHEMBL21442028 0.79 CHRNB2 (0.37)
SCHEMBL7721751 0.79 CHRNB2 (0.37)
SCHEMBL8232225 0.79 CHRNB2 (0.37)
SCHEMBL2055326 0.79 CHRNB2 (0.37)
SCHEMBL2055320 0.79 CHRNB2 (0.37)
SCHEMBL2108480 0.79 CHRNB2 (0.37)
SCHEMBL1569371 0.79 CHRNB2 (0.37)
SCHEMBL30872937 0.79 CHRNB2 (0.37)

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
CN-114456101-A Synthesis method of key intermediate for synthesizing PF-07321332 上海璨谊生物科技有限公司 2022-05-10 CN disclosed