SCHEMBL29267379

SCHEMBL29267379

CCCC[C@@H](C(=O)O)N(CCC)C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TLR2 O60603 4/20 0.41
▸ PTGIR P43119 1/20 0.41
▸ KMT2A Q03164 2/20 0.40
▸ FABP5 Q01469 3/20 0.40
▸ FABP7 O15540 2/20 0.40
▸ CASP3 P42574 1/20 0.37
▸ MDM2 Q00987 1/20 0.36
▸ TNF P01375 1/20 0.36
▸ EPHX2 P34913 1/20 0.36

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
SCHEMBL29267381 1.00 TLR2 (0.41) TLR2PTGIRKMT2AFABP5FABP7
SCHEMBL29267378 1.00 TLR2 (0.41) TLR2PTGIRKMT2AFABP5FABP7
SCHEMBL29267374 0.92 TLR2 (0.41) TLR2KMT2AFABP5FABP7CASP3
SCHEMBL29267377 0.92 TLR2 (0.41) TLR2KMT2AFABP5FABP7CASP3
SCHEMBL29267389 0.92 TLR2 (0.41) TLR2KMT2AFABP5FABP7CASP3
SCHEMBL30792872 0.89 PTGIR (0.42) TLR2PTGIRKMT2AFABP5FABP7
SCHEMBL31688526 0.88 PTGIR (0.41) PTGIRKMT2AFABP5FABP7CASP3
SCHEMBL30640771 0.88 CASP3 (0.44) PTGIRKMT2AFABP5FABP7CASP3
SCHEMBL31681823 0.88 PTGIR (0.41) PTGIRKMT2AFABP5FABP7CASP3
SCHEMBL8488286 0.87 TLR2 (0.42) TLR2KMT2AFABP5FABP7CASP3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114195684-B Synthesis method of amino protecting group N-substituted chiral amino acid 马鞍山诺恩特医药科技有限公司 2023-10-20 — — CN disclosed
CN-114195684-A Synthesis method of amino protecting group N-substituted chiral amino acid 马鞍山诺恩特医药科技有限公司 2022-03-18 — — CN disclosed
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