SCHEMBL25699733

SCHEMBL25699733

CC(CCN1CCC[C@H](C(C)C)C1=O)C1CCCN(C)C1=O

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PER2 O15055 3/20 0.39
CRY2 Q49AN0 2/20 0.39
PIK3CD O00329 2/20 0.32

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
SCHEMBL22601863 0.88 PIK3CD (0.37) PER2CRY2PIK3CD
SCHEMBL18666722 0.86 PER2 (0.44) PER2CRY2PIK3CD
SCHEMBL13283514 0.83 BRD4 (0.38) PER2CRY2PIK3CD
SCHEMBL13341984 0.83 BRD4 (0.38) PER2CRY2PIK3CD
SCHEMBL18651543 0.83 BRD4 (0.38) PER2CRY2PIK3CD
SCHEMBL12875896 0.78 BRD4 (0.37) PER2CRY2PIK3CD
SCHEMBL14192259 0.78 BRD4 (0.37) PER2CRY2PIK3CD
SCHEMBL18883363 0.75 PER2 (0.44) PER2CRY2PIK3CD
SCHEMBL18656860 0.75 ALDH1A1 (0.39) PIK3CD
SCHEMBL18651546 0.72 PER2 (0.42) PER2CRY2PIK3CD

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
US-20230206644-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AS JAK INHIBITORS GENENTECH, INC. (US) 2023-06-29 US disclosed