SCHEMBL29965443

SCHEMBL29965443

CC(C)(C)c1nc(Cl)nc2c1C(=O)NCC2

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 18/20 0.40
PDE4A P27815 2/20 0.34
PDE4C Q08493 2/20 0.34
PDE4D Q08499 2/20 0.34
CDC7 O00311 1/20 0.33
RIPK3 Q9Y572 1/20 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
SCHEMBL31145931 0.80 PDE4B (0.41) PDE4BPDE4APDE4CPDE4D
SCHEMBL28677927 0.63 PDE4B (0.49) PDE4BCDC7
SCHEMBL20757040 0.62 GRM5 (0.46) PDE4B
SCHEMBL26453573 0.61 PARP10 (0.45)
SCHEMBL18352015 0.61 PDE4B (0.38) PDE4BPDE4APDE4CPDE4D
SCHEMBL25797393 0.61 PARP1 (0.51) PDE4BRIPK3
SCHEMBL23314219 0.60 MAP4K1 (0.38)
SCHEMBL17174633 0.60 L3MBTL1 (0.34) CDC7
SCHEMBL23487968 0.60 CHEK1 (0.33) PDE4BPDE4APDE4CPDE4D
SCHEMBL5133297 0.60 PDE4B (0.49) PDE4BCDC7

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-2022226668-A1 HALO-SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-11-03 WO disclosed