SCHEMBL31361688

SCHEMBL31361688

CSc1ncc(C(=O)Nc2c(Cl)cccc2Cl)c(OC2CCC2)n1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.46
PDE4B Q07343 4/20 0.45
PDE4A P27815 2/20 0.45
PDE4C Q08493 2/20 0.45
PDE4D Q08499 2/20 0.45
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
ALDH1A1 P00352 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MAPT P10636 2/20 0.43
AHR P35869 1/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.41
THRB P10828 1/20 0.41
HPGD P15428 1/20 0.40
LCK P06239 1/20 0.39
MAPK14 Q16539 1/20 0.39
NPC1 O15118 1/20 0.39

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
SCHEMBL31361629 0.96 KMT2A (0.47) RXFP1PDE4BPDE4APDE4CPDE4D
SCHEMBL31361675 0.89 DHODH (0.46) RXFP1PDE4BKMT2AMEN1ALDH1A1
SCHEMBL31361585 0.88 PDE4B (0.46) RXFP1PDE4BPDE4APDE4CPDE4D
SCHEMBL31361656 0.84 PDE4B (0.42) RXFP1PDE4BKMT2AMEN1ALDH1A1
SCHEMBL31361632 0.84 PDE4B (0.55) RXFP1PDE4BKMT2AMEN1ALDH1A1
SCHEMBL31361701 0.84 KMT2A (0.46) RXFP1PDE4BPDE4APDE4CPDE4D
SCHEMBL31361690 0.83 KMT2A (0.48) RXFP1PDE4BKMT2AMEN1ALDH1A1
SCHEMBL31361695 0.83 AHR (0.43) RXFP1PDE4BKMT2AMEN1ALDH1A1
SCHEMBL31361724 0.82 KMT2A (0.54) RXFP1PDE4BKMT2AMEN1ALDH1A1
SCHEMBL30962741 0.82 PDE4A (0.43) PDE4BPDE4APDE4CPDE4DMAPT

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-2025017116-A1 PHARMACEUTICAL COMPOUNDS HAVING ACTIVITY AS WEE1 INHIBITORS SENTINEL ONCOLOGY LIMITED (GB) 2025-01-23 WO disclosed