SCHEMBL8716786

SCHEMBL8716786

O=CCOP(=O)(CC(F)(F)F)OCC(F)(F)F

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
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
SCHEMBL575606 0.85 SMN1; SMN2 (0.36) SMN1; SMN2
SCHEMBL778185 0.82 ALDH1A1 (0.31)
SCHEMBL19347772 0.77 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL778819 0.75 TSHR (0.46) SMN1; SMN2
SCHEMBL778817 0.75 ALDH1A1 (0.30)
SCHEMBL779200 0.72 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL777014 0.72 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL8716784 0.69
SCHEMBL9558843 0.68 TSHR (0.32) SMN1; SMN2
SCHEMBL575493 0.67 TSHR (0.52) SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0537996-B1 Avermectin compounds with a 6,5-spiroketal ring system and a 23-acyl substituent MERCK & CO INC (US) 1998-01-07 EP disclosed