SCHEMBL7298656

SCHEMBL7298656

[CH2]CCOCCOCC1CCC1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.33
SPHK2 Q9NRA0 4/20 0.31
SPHK1 Q9NYA1 4/20 0.31
GBA1 P04062 2/20 0.30
UGCG Q16739 2/20 0.30
GBA2 Q9HCG7 2/20 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
SCHEMBL129491 0.95
SCHEMBL6305480 0.88 SPHK1 (0.38) NAAASPHK2SPHK1GBA1UGCG
SCHEMBL126364 0.85
SCHEMBL131976 0.84 SPHK1 (0.35) SPHK2SPHK1GBA1UGCGGBA2
SCHEMBL7303667 0.84 SPHK2 (0.35) NAAASPHK2SPHK1GBA1UGCG
SCHEMBL126800 0.82 TSHR (0.38) SPHK2SPHK1GBA1UGCGGBA2
SCHEMBL131035 0.80 SPHK1 (0.40) SPHK2SPHK1GBA1UGCGGBA2
SCHEMBL5168 0.75
SCHEMBL4497381 0.74 NFE2L2 (0.36)
SCHEMBL12268104 0.74 TSHR (0.34) NAAASPHK2SPHK1GBA1UGCG

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-0400519-A1 2-Hydroxy-n-propylamines, medicaments containing these compounds and method for preparing them Dr. Karl Thomae GmbH (DE) 1990-12-05 EP disclosed