SCHEMBL9414836

SCHEMBL9414836

NC1CCc2sc(Cl)cc2C1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.43
DRD3 P35462 3/20 0.43
OPRK1 P41145 1/20 0.43
MAPT P10636 2/20 0.43
NFKB1 P19838 1/20 0.43
THPO P40225 1/20 0.43
HIF1A Q16665 1/20 0.43
HSD17B10 Q99714 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
KDM4E B2RXH2 1/20 0.42
PLAU P00749 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
SCHEMBL31563899 1.00 DRD2 (0.43) DRD2DRD3OPRK1MAPTNFKB1
SCHEMBL31564089 1.00 DRD2 (0.43) DRD2DRD3OPRK1MAPTNFKB1
Hydrochloric Acid SCHEMBL31564255 0.76 PNMT (0.43) DRD2DRD3OPRK1MAPTNFKB1
SCHEMBL31564341 0.74 MAPT (0.40) DRD2DRD3OPRK1MAPTNFKB1
SCHEMBL20858651 0.74 ALDH1A1 (0.37) ALDH1A1
SCHEMBL31563807 0.74 DRD2 (0.38) DRD2DRD3ALDH1A1
SCHEMBL31564100 0.74 DRD2 (0.38) DRD2DRD3ALDH1A1
SCHEMBL31563923 0.74 DRD2 (0.38) DRD2DRD3ALDH1A1
Hydrochloric Acid SCHEMBL31563867 0.73 DRD2 (0.46) DRD2DRD3
Hydrochloric Acid SCHEMBL31564138 0.73 DRD2 (0.37) DRD2DRD3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025097104-A1 THIENYL COMPOUNDS FOR THE TREATMENT OF A CENTRAL NERVOUS SYSTEM DISEASE OR DISORDER PGI DRUG DISCOVERY LLC (US) 2025-05-08 WO claimed
WO-2025097104-A1 THIENYL COMPOUNDS FOR THE TREATMENT OF A CENTRAL NERVOUS SYSTEM DISEASE OR DISORDER PGI DRUG DISCOVERY LLC (US) 2025-05-08 WO disclosed
EP-0579059-A1 Pyridazinone derivatives and processes for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1994-01-19 EP disclosed