SCHEMBL29267382

SCHEMBL29267382

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

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FABP5 Q01469 3/20 0.42
▸ FABP7 O15540 2/20 0.42
▸ KMT2A Q03164 2/20 0.40
▸ CASP3 P42574 1/20 0.39
▸ TLR2 O60603 2/20 0.39
▸ PTGIR P43119 1/20 0.38
▸ EPHX2 P34913 1/20 0.38
▸ MDM4 O15151 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL29267373 1.00 FABP5 (0.42) FABP5FABP7KMT2ACASP3TLR2
SCHEMBL29267376 1.00 FABP5 (0.42) FABP5FABP7KMT2ACASP3TLR2
SCHEMBL30566274 1.00 FABP5 (0.42) FABP5FABP7KMT2ACASP3TLR2
SCHEMBL29267377 0.93 TLR2 (0.41) FABP5FABP7KMT2ACASP3TLR2
SCHEMBL29267374 0.93 TLR2 (0.41) FABP5FABP7KMT2ACASP3TLR2
SCHEMBL29267389 0.93 TLR2 (0.41) FABP5FABP7KMT2ACASP3TLR2
SCHEMBL29080291 0.89 KMT2A (0.40) FABP5FABP7KMT2ACASP3TLR2
SCHEMBL29080293 0.89 KMT2A (0.40) FABP5FABP7KMT2ACASP3TLR2
SCHEMBL16288980 0.88 PPARG (0.43) FABP5FABP7KMT2ACASP3EPHX2
SCHEMBL15083099 0.88 PPARG (0.43) FABP5FABP7KMT2ACASP3EPHX2

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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