SCHEMBL30893341

SCHEMBL30893341

CC(C)(C)OC(=O)NC1CCN(CCCCN)CC1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.53
CTSK P43235 2/20 0.48
DRD2 P14416 6/20 0.45
CCR5 P51681 1/20 0.45
DRD3 P35462 2/20 0.44
SMYD3 Q9H7B4 1/20 0.42
BTK Q06187 1/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CYP2C9 P11712 1/20 0.41
HSD11B1 P28845 1/20 0.41
F2 P00734 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
ST14 Q9Y5Y6 1/20 0.40
HRH2 P25021 1/20 0.40
HRH1 P35367 1/20 0.40

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
SCHEMBL26813917 0.99 KCNA3 (0.52) KCNA3CTSKDRD2CCR5DRD3
SCHEMBL26814319 0.99 KCNA3 (0.52) KCNA3CTSKDRD2CCR5DRD3
SCHEMBL9092293 0.96 KCNA3 (0.54) KCNA3CTSKDRD2CCR5DRD3
SCHEMBL26813083 0.92 KCNA3 (0.49) KCNA3CTSKDRD2CCR5DRD3
SCHEMBL7222795 0.90 KCNA3 (0.56) KCNA3CTSKDRD2CCR5DRD3
SCHEMBL24690239 0.88 KCNA3 (0.54) KCNA3CTSKDRD2CCR5DRD3
SCHEMBL26813557 0.86 KCNA3 (0.53) KCNA3CTSKDRD2CCR5DRD3
SCHEMBL26814329 0.86 KCNA3 (0.53) KCNA3CTSKDRD2CCR5DRD3
SCHEMBL26814285 0.86 KCNA3 (0.53) KCNA3CTSKDRD2CCR5DRD3
SCHEMBL2828349 0.86 KCNA3 (0.53) KCNA3CTSKDRD2CCR5DRD3

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
WO-2024097948-A1 DEGRADERS OF MDM2 AND USES THEREOF ROIVANT DISCOVERY, INC. (US) 2024-05-10 WO disclosed