SCHEMBL18755364

SCHEMBL18755364

CCO[C@H]1[C@H](C)O[C@@H](C)C[C@@H]1OCC

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL18755362 1.00 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2
SCHEMBL18755382 0.89 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2
SCHEMBL13985336 0.78 PPP5C (0.40) ALDH1A1SMN1; SMN2
SCHEMBL18755370 0.77 ALDH1A1 (0.32) ALDH1A1SMN1; SMN2
SCHEMBL15623932 0.73 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2
SCHEMBL6362246 0.72 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2
SCHEMBL18755373 0.71
SCHEMBL17053355 0.71 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2
SCHEMBL18755366 0.71
SCHEMBL13747439 0.71

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-1370566-B1 SYNTHETIC DERIVATIVES OF 21-BUTENYL AND RELATED SPINOSYNS DOW AGROSCIENCES LLC (US) 2017-04-19 EP disclosed