SCHEMBL9000152

SCHEMBL9000152

CCOP(=O)(C[S+]([O-])Cc1nc[nH]n1)OCC

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32

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
SCHEMBL11553770 0.71 NPSR1 (0.41) TSHR
SCHEMBL9000159 0.71 TSHR (0.35) TSHR
SCHEMBL29131267 0.71 NPSR1 (0.41) TSHR
SCHEMBL9000115 0.70 TSHR (0.34) TSHR
SCHEMBL9000144 0.69 TSHR (0.33) TSHR
SCHEMBL8389801 0.68 MAPT (0.38) TSHR
SCHEMBL11207824 0.67 MAPT (0.32) TSHR
SCHEMBL808113 0.64 TSHR (0.50) TSHR
SCHEMBL8762965 0.62 TSHR (0.32) TSHR
SCHEMBL251527 0.61

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
EP-0730408-A1 TRIAZOLE PHOSPHONATE PESTICIDES AgrEvo UK Limited (GB) 1996-09-11 EP disclosed
WO-1995014385-A1 TRIAZOLE PHOSPHONATE PESTICIDES AGREVO UK LIMITED (GB) 1995-06-01 WO disclosed