SCHEMBL31703836

SCHEMBL31703836

COc1cc(-c2nc(C(=O)NCc3cccc[n+]3[O-])cs2)ccc1Cl

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 3/20 0.52
▸ ALDH1A1 P00352 2/20 0.45
▸ CHEK1 O14757 2/20 0.44
▸ MAPT P10636 3/20 0.43
▸ IRAK4 Q9NWZ3 3/20 0.43
▸ HTT P42858 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ DRD4 P21917 1/20 0.41
▸ EIF4E P06730 1/20 0.40
▸ GAA P10253 2/20 0.40
▸ HPGDS O60760 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ HPGD P15428 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ GRM4 Q14833 1/20 0.39
▸ HDAC6 Q9UBN7 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
SCHEMBL31704046 0.89 MAPT (0.52) TLR7ALDH1A1MAPTIRAK4NPSR1
SCHEMBL31703867 0.89 CYP2C9 (0.43) TLR7ALDH1A1MAPTIRAK4NPSR1
SCHEMBL31703864 0.88 IRAK4 (0.45) TLR7ALDH1A1MAPTIRAK4NPSR1
SCHEMBL31703666 0.88 TLR7 (0.49) TLR7ALDH1A1CHEK1MAPTIRAK4
SCHEMBL31703848 0.86 IRAK4 (0.45) TLR7ALDH1A1MAPTIRAK4NPSR1
SCHEMBL31703745 0.86 IRAK4 (0.47) TLR7ALDH1A1MAPTIRAK4NPSR1
SCHEMBL31703892 0.84 MAPT (0.47) TLR7ALDH1A1MAPTIRAK4HTT
SCHEMBL31703731 0.84 IRAK4 (0.45) TLR7ALDH1A1MAPTIRAK4NPSR1
SCHEMBL31703950 0.84 ALDH1A1 (0.44) TLR7ALDH1A1MAPTIRAK4NPSR1
SCHEMBL31704087 0.83 TLR7 (0.56) TLR7ALDH1A1MAPTIRAK4HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025215450-A1 THIAZOLE COMPOUNDS AS SODIUM CHANNEL BLOCKERS SK BIOPHARMACEUTICALS CO., LTD. (KR) 2025-10-16 — — WO claimed
WO-2025215450-A1 THIAZOLE COMPOUNDS AS SODIUM CHANNEL BLOCKERS SK BIOPHARMACEUTICALS CO., LTD. (KR) 2025-10-16 — — WO disclosed
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