SCHEMBL19851510

SCHEMBL19851510

CCCCCCCCCCCCCCOCC(CNC(=O)C(CCC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)OCCCCCCCCCCCCCC

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 19/20 0.58
CTSS P25774 1/20 0.47
CTSK P43235 1/20 0.47

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
SCHEMBL19839557 0.92 TLR2 (0.58) TLR2CTSSCTSK
SCHEMBL19839559 0.92 TLR2 (0.58) TLR2CTSSCTSK
SCHEMBL19851629 0.90 TLR2 (0.55) TLR2CTSSCTSK
SCHEMBL19851698 0.87 TLR2 (0.63) TLR2CTSSCTSK
SCHEMBL19851509 0.86 TLR2 (0.56) TLR2CTSSCTSK
SCHEMBL19839694 0.86 TLR2 (0.55) TLR2CTSSCTSK
SCHEMBL19839692 0.86 TLR2 (0.55) TLR2CTSSCTSK
SCHEMBL19851749 0.85 TLR2 (0.57) TLR2
SCHEMBL19851500 0.83 TLR2 (0.76) TLR2
SCHEMBL19851522 0.82 TLR2 (0.70) 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