SCHEMBL19851634

SCHEMBL19851634

COCCCCCOCC(CNC[C@@](C=O)(CCCCN)NCc1ccccc1)OCCCCCOC

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 20/20 0.48

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
SCHEMBL19851743 0.94 TLR2 (0.55) TLR2
SCHEMBL19851732 0.79 TLR2 (0.48) TLR2
SCHEMBL19851669 0.73 TLR2 (0.48) TLR2
Hydrochloric Acid SCHEMBL19839696 0.71 TLR2 (0.88) TLR2
SCHEMBL19839849 0.70 TLR2 (0.57) TLR2
SCHEMBL19839562 0.70 TLR2 (0.57) TLR2
SCHEMBL19851636 0.70 TLR2 (0.53) TLR2
SCHEMBL25837482 0.68 PLA2G10 (0.47) TLR2
SCHEMBL19851748 0.67 CASR (0.41)
SCHEMBL19839624 0.65 TLR2 (1.00) TLR2

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
WO-2018026866-A1 LIPID-SUBSTITUTED AMINO 1,2-AND 1,3-DIOL COMPOUNDS AS MODULATORS OF TLR2 DIMERIZATION NEUROPORE THERAPIES, INC. (US) 2018-02-08 WO disclosed