SCHEMBL19851476

SCHEMBL19851476

CCCCCCCCCCCCCCOCC(CNC(=O)[C@H](CCCCN)NC(=O)OCC1c2ccccc2-c2ccccc21)OCCCCCCCCCCCCCC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 20/20 1.00

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
SCHEMBL19839591 0.90 TLR2 (0.81) TLR2
SCHEMBL19839593 0.90 TLR2 (0.81) TLR2
SCHEMBL19851676 0.89 TLR2 (0.81) TLR2
SCHEMBL19851626 0.88 TLR2 (0.78) TLR2
SCHEMBL19839648 0.88 TLR2 (0.78) TLR2
SCHEMBL19839647 0.88 TLR2 (0.78) TLR2
SCHEMBL19851500 0.86 TLR2 (0.76) TLR2
SCHEMBL16328802 0.85 TLR2 (0.73) TLR2
SCHEMBL19851501 0.84 TLR2 (0.73) TLR2
SCHEMBL19851618 0.84 TLR2 (0.73) 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