SCHEMBL31362508

SCHEMBL31362508

CN(C)C(=O)CN1CCc2ncc(B(O)O)cc2C1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.44
CDK4 P11802 1/20 0.37
CDK2 P24941 1/20 0.37
CDK6 Q00534 1/20 0.37
HTR6 P50406 1/20 0.36
ALK Q9UM73 4/20 0.36
WEE1 P30291 1/20 0.35
CDK9 P50750 5/20 0.35
CCNT1 O60563 4/20 0.35
TLR9 Q9NR96 4/20 0.35
TLR8 Q9NR97 4/20 0.35
TLR7 Q9NYK1 4/20 0.35
INSR P06213 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HSP90AA1 P07900 1/20 0.33

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
SCHEMBL31362571 0.91 DRD2 (0.46) DRD2CDK4CDK2CDK6HTR6
SCHEMBL31362450 0.84 DRD2 (0.42) DRD2CDK4CDK2CDK6HTR6
SCHEMBL31362283 0.78 PDCD1 (0.38) DRD2
SCHEMBL24752579 0.76 CYP2C19 (0.44) MEN1KMT2AHSP90AA1
SCHEMBL30032785 0.76 CYP2C19 (0.44) MEN1KMT2AHSP90AA1
SCHEMBL31362368 0.75 DRD2 (0.44) DRD2CDK4CDK2CDK6HTR6
SCHEMBL25429414 0.71 MAPK1 (0.49) CDK4CDK2CDK6CDK9MEN1
SCHEMBL30519665 0.71 MAPT (0.52)
SCHEMBL2559734 0.71 MAPT (0.52)
SCHEMBL20910192 0.69 MEN1 (0.49) DRD2MEN1KMT2A

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-2025034858-A1 FUSED PYRIDINES FOR THE TREATMENT OF CANCER AND OTHER INDICATIONS THERAS, INC. (US) 2025-02-13 WO disclosed