SCHEMBL19213221

SCHEMBL19213221

CCCCC(F)(F)C(C)(C)C(F)(F)C(F)(F)CCCC

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.30
LPAR1 Q92633 1/20 0.30
LPAR3 Q9UBY5 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
SCHEMBL19213218 0.84 TSHR (0.35) CES2LPAR1LPAR3
SCHEMBL23395470 0.82 CES2 (0.31) CES2LPAR1LPAR3
SCHEMBL8916549 0.80 CES2 (0.30) CES2LPAR1LPAR3
SCHEMBL16473057 0.80 CES2 (0.30) CES2LPAR1LPAR3
SCHEMBL7719962 0.79 CES2 (0.32) CES2LPAR1LPAR3
SCHEMBL19514067 0.78
SCHEMBL16473059 0.78
SCHEMBL16473060 0.78
SCHEMBL19213219 0.78 TSHR (0.40) CES2LPAR1LPAR3
SCHEMBL14732325 0.77 CES2 (0.31) CES2LPAR1LPAR3

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-20170229735-A1 GEL POLYMER ELECTROLYTE AND LITHIUM SECONDARY BATTERY COMPRISING THE SAME LG CHEM, LTD. (KR) 2017-08-10 US disclosed