SCHEMBL23639161

SCHEMBL23639161

CC1(C)CCN(c2cnc3c(n2)N(CC(=O)OC(C)(C)C)NC3)CC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 4/20 0.35
SKP1 P63208 4/20 0.35
SKP2 Q13309 4/20 0.35
RET P07949 2/20 0.32
CRBN Q96SW2 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP11B2 P19099 1/20 0.32
PIK3R1 P27986 4/20 0.31
PIK3CA P42336 4/20 0.31
PTPN11 Q06124 2/20 0.31
DDB1 Q16531 1/20 0.31
JAK3 P52333 1/20 0.31
BTK Q06187 1/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CB P42338 1/20 0.31
WNT1 P04628 1/20 0.30
GSK3B P49841 1/20 0.30
DYRK1A Q13627 1/20 0.30
GPR119 Q8TDV5 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
SCHEMBL23055428 0.74 KDM4E (0.36) CKS1BSKP1SKP2RETKDM4E
SCHEMBL23055432 0.69 RET (0.36) CKS1BSKP1SKP2RETPIK3R1
SCHEMBL24784245 0.68 RET (0.34) CKS1BSKP1SKP2RETJAK3
SCHEMBL31531412 0.65 PLA2G10 (0.39) WNT1GSK3BDYRK1A
SCHEMBL23055346 0.65
SCHEMBL21591643 0.60 CKS1B (0.55) CKS1BSKP1SKP2CRBNALDH1A1
SCHEMBL23639174 0.60 CKS1B (0.39) CKS1BSKP1SKP2KDM4EALDH1A1
SCHEMBL23055431 0.59 GRIN2B (0.38) PTPN11
SCHEMBL7346164 0.59 UBE2T (0.44) RETCRBNWNT1GSK3BDYRK1A
SCHEMBL19785238 0.59 RET (0.45) CKS1BSKP1SKP2RETJAK3

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-2021141041-A1 THERAPEUTIC AGENT FOR TAUOPATHIES 大日本住友製薬株式会社 2021-07-15 WO disclosed