SCHEMBL9000197

SCHEMBL9000197

CCOP(=O)(CS(=O)(=O)Cn1cncn1)OCC

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.36
TSHR P16473 1/20 0.32
EGLN3 Q9H6Z9 1/20 0.32
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL9000191 0.75 FDPS (0.43) FDPSTSHREGLN3ALDH1A1MAPT
SCHEMBL10884318 0.72 TSHR (0.43) TSHRALDH1A1MAPTSMN1; SMN2
SCHEMBL9000139 0.72 FDPS (0.41) FDPSTSHREGLN3
SCHEMBL27267342 0.71 EGLN3 (0.42) FDPSEGLN3ALDH1A1MAPTSMN1; SMN2
SCHEMBL10881742 0.70 POLB (0.40) FDPS
SCHEMBL9961218 0.69 TSHR (0.52) TSHR
SCHEMBL10883268 0.69 FDPS (0.50) FDPSTSHREGLN3ALDH1A1
SCHEMBL10884315 0.67 FDPS (0.48) FDPSEGLN3ALDH1A1
SCHEMBL9000178 0.66 FDPS (0.36) FDPSEGLN3ALDH1A1MAPTSMN1; SMN2
SCHEMBL10881738 0.65 NLRP3 (0.36)

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