SCHEMBL11213426

SCHEMBL11213426

CN(C)C(CO)C(O)CN

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SPHK2 Q9NRA0 2/20 0.35
▸ SPHK1 Q9NYA1 2/20 0.35
▸ CETP P11597 1/20 0.35
▸ SLC6A2 P23975 1/20 0.32
▸ SLC6A4 P31645 1/20 0.32
▸ TDP1 Q9NUW8 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
SCHEMBL15750870 0.81 LMNA (0.40) SPHK2SPHK1CETPTDP1
SCHEMBL28174190 0.80 AOC3 (0.34) SLC6A2SLC6A4
SCHEMBL25058928 0.77 SPHK2 (0.40) SPHK2SPHK1CETPTDP1
SCHEMBL27843911 0.76 SPHK2 (0.33) SPHK2SPHK1CETP
SCHEMBL28136543 0.75 SPHK2 (0.35) SPHK2SPHK1CETPSLC6A2SLC6A4
SCHEMBL4145583 0.73 LMNA (0.48) SPHK2SPHK1CETP
SCHEMBL2323248 0.71 AOC3 (0.32) SLC6A2SLC6A4
SCHEMBL2009746 0.70 — —
SCHEMBL3386408 0.70 SPHK1 (0.36) SPHK2SPHK1CETP
SCHEMBL4069266 0.70 SPHK2 (0.36) SPHK2SPHK1CETP

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-4379024-A Process for the manufacture of alkylaminoalkanol PENNWALT CORPORATION (US) 1983-04-05 — — US disclosed
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