SCHEMBL9422992

SCHEMBL9422992

COC(C)OCOCCCCCCCC[C@@H]1O[C@H]1CO

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SPHK2 Q9NRA0 3/20 0.34
SPHK1 Q9NYA1 2/20 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
SCHEMBL9423030 0.80 SPHK2 (0.32) SPHK2SPHK1
SCHEMBL9422991 0.79 PRKCA (0.33) SPHK2SPHK1
SCHEMBL9422919 0.76 MEN1 (0.35)
SCHEMBL27933404 0.76 SPHK2 (0.37) SPHK2SPHK1
SCHEMBL9422990 0.72
SCHEMBL11259005 0.71 PRKD3 (0.42) SPHK1
SCHEMBL23924545 0.69 LMNA (0.36) SPHK2SPHK1
SCHEMBL9423019 0.69 LPAR3 (0.39)
SCHEMBL8798088 0.68 ALDH1A1 (0.52)
SCHEMBL8800129 0.68 ALDH1A1 (0.52)

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
US-5336436-A Quick response HOECHST AKTIENGESELLSCHAFT (DE) 1994-08-09 US disclosed