SCHEMBL3676649

SCHEMBL3676649

CCCCCCCCCCCCC(N)C(C)(O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 2/20 0.48
OPRM1 P35372 1/20 0.46
CYP2D6 P10635 2/20 0.45
LMNA P02545 2/20 0.45
TP53 P04637 2/20 0.45
LAP3 P28838 2/20 0.45
GMNN O75496 1/20 0.45
POLB P06746 1/20 0.45
THPO P40225 1/20 0.45
MTOR P42345 1/20 0.45
BLM P54132 1/20 0.45
KDM4E B2RXH2 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
MAPT P10636 1/20 0.45
CETP P11597 1/20 0.45
HTT P42858 1/20 0.45
UBE2N P61088 1/20 0.45
GRIK1 P39086 2/20 0.44
GRIK2 Q13002 2/20 0.44

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
SCHEMBL3678206 1.00 SPHK1 (0.48) SPHK1OPRM1CYP2D6LMNATP53
Bromide SCHEMBL29736332 0.98 SPHK1 (0.47) SPHK1OPRM1CYP2D6LMNATP53
Water SCHEMBL15417076 0.84 SPHK1 (0.47) SPHK1OPRM1CYP2D6LMNATP53
SCHEMBL4540120 0.84 SPHK1 (0.50) SPHK1OPRM1CYP2D6LMNATP53
SCHEMBL9575917 0.84 SPHK1 (0.50) SPHK1OPRM1CYP2D6LMNATP53
SCHEMBL8871150 0.84 SPHK1 (0.50) SPHK1OPRM1CYP2D6LMNATP53
SCHEMBL9575723 0.84 SPHK1 (0.50) SPHK1OPRM1CYP2D6LMNATP53
SCHEMBL1408425 0.82 SPHK1 (0.48) SPHK1OPRM1CYP2D6LMNATP53
Hydrochloric Acid SCHEMBL2060002 0.82 SPHK1 (0.48) SPHK1OPRM1CYP2D6LMNATP53
Hydrochloric Acid SCHEMBL9794781 0.82 SPHK1 (0.48) SPHK1OPRM1CYP2D6LMNATP53

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7825179-B2 Biodegradable resin composition, production method therefor, and product molded or formed therefrom UNITIKA LTD. (JP) 2010-11-02 US disclosed
US-20090298977-A1 Biodegradable Resin Composition, Production Method Therefor, and Product Molded or Formed Therefrom UNITIKA LTD. (JP) 2009-12-03 US disclosed
EP-1932884-A1 BIODEGRADABLE RESIN COMPOSITION, PROCESS FOR PRODUCTION OF THE SAME, AND MOLDED ARTICLE USING THE SAME Unitika Ltd. (JP) 2008-06-18 EP disclosed