SCHEMBL24746252

SCHEMBL24746252

Cc1ccc(C2CCN(C)C(=O)C2)cn1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 8/20 0.41
TNKS O95271 1/20 0.40
MAPK1 P28482 3/20 0.38
TLR8 Q9NR97 1/20 0.38
TLR7 Q9NYK1 1/20 0.38
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37

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
SCHEMBL16690791 0.84 MAPK1 (0.41) BRD4MAPK1
SCHEMBL16690790 0.84 TNKS (0.41) BRD4TNKSMAPK1
SCHEMBL23108841 0.82 MAPK1 (0.40) BRD4MAPK1TLR8TLR7
SCHEMBL23133583 0.82 BRD4 (0.38) BRD4MAPK1
SCHEMBL23102773 0.82 BRD4 (0.38) BRD4MAPK1PDE4APDE4BPDE4C
SCHEMBL23102761 0.82 MAPK1 (0.40) BRD4MAPK1TLR8TLR7
SCHEMBL25147361 0.82 BRD4 (0.38) BRD4MAPK1PDE4APDE4BPDE4C
SCHEMBL23425724 0.82 BRD4 (0.38) BRD4MAPK1PDE4APDE4BPDE4C
SCHEMBL23102775 0.82 MAPK1 (0.40) BRD4MAPK1TLR8TLR7
SCHEMBL15448420 0.80 BRD4 (0.50) BRD4PDE4APDE4BPDE4CPDE4D

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-2022174253-A1 HPK1 ANTAGONISTS AND USES THEREOF Nimbus Saturn, Inc. (US) 2022-08-18 WO disclosed