SCHEMBL2417963

SCHEMBL2417963

CCCCCCCCCCCCCC(=O)OCC(CSCC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O)OC(=O)CCCCCCCCCCCCC

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TLR2 O60603 18/20 0.56
▸ TNF P01375 2/20 0.54

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
SCHEMBL29401634 1.00 TLR2 (0.56) TLR2TNF
SCHEMBL2418982 1.00 TLR2 (0.56) TLR2TNF
SCHEMBL29575414 1.00 TLR2 (0.56) TLR2TNF
SCHEMBL9084958 1.00 TLR2 (0.56) TLR2TNF
SCHEMBL2453889 1.00 TLR2 (0.56) TLR2TNF
SCHEMBL14762587 1.00 TLR2 (0.56) TLR2TNF
SCHEMBL2451299 1.00 TLR2 (0.56) TLR2TNF
SCHEMBL616109 1.00 TLR2 (0.56) TLR2TNF
SCHEMBL3986349 1.00 TLR2 (0.56) TLR2TNF
SCHEMBL30869073 1.00 TLR2 (0.56) TLR2TNF

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-2011119759-A1 COMPOUNDS (CYSTEIN BASED LIPOPEPTIDES) AND COMPOSITIONS AS TLR2 AGONISTS USED FOR TREATING INFECTIONS, INFLAMMATIONS, RESPIRATORY DISEASES ETC. IRM LLC (BM) 2011-09-29 — — WO disclosed
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