SCHEMBL6206708

SCHEMBL6206708

OCC1NCC2CCCC=C2C1O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 7/20 0.35
MGAM O43451 4/20 0.35
GLA P06280 4/20 0.35
AGL P35573 3/20 0.35
SI P14410 3/20 0.35
PYGL P06737 2/20 0.35
MAN1B1 Q9UKM7 1/20 0.35
FUCA1 P04066 4/20 0.34
GBA2 Q9HCG7 3/20 0.34
GBA1 P04062 3/20 0.34
MEN1 O00255 2/20 0.34
ALOX15 P16050 2/20 0.34
KMT2A Q03164 2/20 0.34
LCT P09848 2/20 0.34
GBA3 Q9H227 2/20 0.34
MAN2B1 O00754 1/20 0.34
MAN2B2 Q9Y2E5 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP2C19 P33261 1/20 0.34
TREH O43280 1/20 0.34

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
SCHEMBL6206711 1.00 GAA (0.35) GAAMGAMGLAAGLSI
SCHEMBL6206710 1.00 GAA (0.35) GAAMGAMGLAAGLSI
SCHEMBL5240397 0.63
SCHEMBL14879909 0.61 ESR2 (0.31)
SCHEMBL901128 0.61 ESR2 (0.31)
SCHEMBL899487 0.61 ESR1 (0.30)
Ammonia Solution, Strong SCHEMBL28327714 0.60
SCHEMBL7911350 0.57
SCHEMBL7911348 0.57
SCHEMBL28047878 0.56

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-1580187-A1 Apoptogenic and antiproliferative analogs of ceramide Deigner, Hans-Peter (DE) 2005-09-28 EP claimed
EP-1580187-A1 Apoptogenic and antiproliferative analogs of ceramide Deigner, Hans-Peter (DE) 2005-09-28 EP disclosed