SCHEMBL19066477

SCHEMBL19066477

CCCCC1CC(O)O[C@H]1C

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.34
GLB1 P16278 1/20 0.33
CYP1A2 P05177 1/20 0.30
FUCA1 P04066 1/20 0.30
LMNA P02545 1/20 0.30
MAPK1 P28482 1/20 0.30
HTT P42858 1/20 0.30
GLA P06280 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
SCHEMBL19084156 1.00 ALOX5 (0.34) ALOX5GLB1CYP1A2FUCA1LMNA
SCHEMBL14883078 0.88 CA1 (0.39)
SCHEMBL9787225 0.74
SCHEMBL18660922 0.72 SPHK2 (0.36) GLB1CYP1A2FUCA1
SCHEMBL9888304 0.71 CHRM5 (0.31) FUCA1
SCHEMBL9888340 0.71 CHRM5 (0.31) FUCA1
SCHEMBL15423553 0.71
SCHEMBL14102500 0.69 GLB1 (0.35) ALOX5GLB1FUCA1GLA
SCHEMBL14883125 0.68 CA1 (0.40)
SCHEMBL14882863 0.68 CA1 (0.40)

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
WO-2017116956-A1 MACROCYCLIC PICOLINAMIDES AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2017-07-06 WO disclosed