SCHEMBL9681868

SCHEMBL9681868

COc1cc(OC)nc(-c2cccc(Cl)c2C(=O)S)n1

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.43
LMNA P02545 1/20 0.40
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38

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
SCHEMBL28345038 0.87
SCHEMBL29176434 0.85 NPSR1 (0.44) NPSR1LMNA
SCHEMBL8320961 0.82 NPSR1 (0.39) NPSR1LMNA
SCHEMBL27309571 0.82 ADORA2A (0.39) NPSR1LMNA
SCHEMBL28429986 0.79
SCHEMBL8959297 0.75 DHODH (0.44) NPSR1
SCHEMBL9681931 0.73 RORC (0.39) NPSR1HCRTR1HCRTR2
SCHEMBL13019373 0.73 SMN1; SMN2 (0.45) NPSR1
SCHEMBL9551256 0.72 POLB (0.36) NPSR1LMNAHCRTR1HCRTR2
SCHEMBL9448737 0.72 NPC1 (0.51) HCRTR1HCRTR2

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
US-5135563-A Herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-08-04 US disclosed
EP-0469711-A1 Pyrimidine derivative SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-02-05 EP disclosed