SCHEMBL31546906

SCHEMBL31546906

Cn1nc(C2CC2)nc1Br

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 4/20 0.45
PDE10A Q9Y233 1/20 0.34
CHRM3 P20309 5/20 0.32
PDE4A P27815 3/20 0.32
PDE4B Q07343 3/20 0.32
PDE4C Q08493 3/20 0.32
PDE4D Q08499 3/20 0.32
AOC3 Q16853 2/20 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
SCHEMBL4470815 0.76 TDP2 (0.46) TDP2PDE10ACHRM3PDE4APDE4B
SCHEMBL20320451 0.76 TDP2 (0.50) TDP2PDE10ACHRM3PDE4APDE4B
SCHEMBL20320448 0.68 TDP2 (0.49) TDP2PDE10ACHRM3PDE4APDE4B
SCHEMBL20106957 0.67 TDP2 (0.40) TDP2AOC3
SCHEMBL6915240 0.66
SCHEMBL1313137 0.64 SIGMAR1 (0.48) TDP2AOC3
SCHEMBL21838383 0.63 DGAT1 (0.34)
SCHEMBL3472625 0.63 TDP2 (1.00) TDP2
SCHEMBL15269532 0.60 KDM4E (0.36) TDP2
SCHEMBL17673143 0.60 MPO (0.34)

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-2025072330-A1 KIT INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARCUS BIOSCIENCES, INC. (US) 2025-04-03 WO disclosed