SCHEMBL25433242

SCHEMBL25433242

COc1ccc(Cn2c(Cl)cc3cccc(F)c3c2=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
MAPT P10636 7/20 0.46
TP53 P04637 2/20 0.46
RXFP1 Q9HBX9 1/20 0.46
LMNA P02545 1/20 0.45
P2RX4 Q99571 1/20 0.44
SLC5A1 P13866 1/20 0.43
SLC5A2 P31639 1/20 0.43
CLTC Q00610 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CHRM5 P08912 1/20 0.43
NPBWR1 P48145 1/20 0.42
ALDH1A1 P00352 2/20 0.42
ALOX15 P16050 1/20 0.42
CMA1 P23946 1/20 0.42
RGS4 P49798 1/20 0.42
RGS8 P57771 1/20 0.42
THRB P10828 1/20 0.42
CYP1A2 P05177 1/20 0.41

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
SCHEMBL31208038 1.00 KDM4E (0.48) KDM4EMAPTTP53RXFP1LMNA
SCHEMBL25432242 0.86 KDM4E (0.44) KDM4EMAPTTP53RXFP1LMNA
SCHEMBL25430713 0.85 KDM4E (0.44) KDM4EMAPTTP53RXFP1LMNA
SCHEMBL25434185 0.83 SLC5A1 (0.43) KDM4EMAPTTP53RXFP1LMNA
SCHEMBL30496099 0.83 SLC5A1 (0.43) KDM4EMAPTTP53RXFP1LMNA
SCHEMBL31528433 0.81 KDM4E (0.41) KDM4EMAPTTP53RXFP1LMNA
SCHEMBL31014731 0.81 TDP1 (0.57) KDM4EMAPTRXFP1P2RX4TDP1
SCHEMBL30496014 0.77 CHRM1 (0.39) KDM4EMAPTTP53RXFP1LMNA
SCHEMBL25433053 0.77 CHRM1 (0.39) KDM4EMAPTTP53RXFP1LMNA
SCHEMBL14743265 0.75 CHRM5 (0.44) KDM4EMAPTTP53LMNAP2RX4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025073554-A2 PARP1 INHIBITOR COMPOUNDS Duke Street Bio Limited (GB) 2025-04-10 WO disclosed
EP-4444305-A2 PHARMACEUTICAL COMPOUND Duke Street Bio Limited (GB) 2024-10-16 EP disclosed
WO-2023156386-A2 PHARMACEUTICAL COMPOUND Duke Street Bio Limited (GB) 2023-08-24 WO disclosed
WO-2023156386-A2 PHARMACEUTICAL COMPOUND Duke Street Bio Limited (GB) 2023-08-24 WO disclosed