SCHEMBL31096183

SCHEMBL31096183

N[C@@H](CC(=O)NC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 1/20 0.43
▸ SLC1A3 P43003 4/20 0.40
▸ SLC1A2 P43004 4/20 0.40
▸ SLC1A1 P43005 4/20 0.40
▸ KIF11 P52732 5/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.37
▸ FNTA P49354 1/20 0.37
▸ FNTB P49356 1/20 0.37
▸ CA2 P00918 2/20 0.36
▸ CA1 P00915 1/20 0.36
▸ DNMT1 P26358 1/20 0.36
▸ TGFBR1 P36897 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
SCHEMBL31142119 0.92 SLC1A3 (0.42) MMESLC1A3SLC1A2SLC1A1KIF11
SCHEMBL30101855 0.92 SLC1A3 (0.42) MMESLC1A3SLC1A2SLC1A1KIF11
SCHEMBL30811214 0.89 MME (0.41) MMESLC1A3SLC1A2SLC1A1FNTA
SCHEMBL30787544 0.88 NPSR1 (0.53) MMENPSR1
SCHEMBL27429550 0.84 ECE1 (0.39) SLC1A3SLC1A2SLC1A1KIF11
SCHEMBL25209459 0.82 SLC1A3 (0.53) SLC1A3SLC1A2SLC1A1KIF11
SCHEMBL21690461 0.82 SLC1A3 (0.53) SLC1A3SLC1A2SLC1A1KIF11
SCHEMBL17477557 0.82 SLC1A3 (0.53) SLC1A3SLC1A2SLC1A1KIF11
SCHEMBL24798442 0.82 KIF11 (0.38) SLC1A3SLC1A2SLC1A1KIF11
Water SCHEMBL29400657 0.81 SLC1A3 (0.51) SLC1A3SLC1A2SLC1A1KIF11

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
EP-4425181-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE Bertis Inc (KR) 2024-09-04 — — EP disclosed
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