SCHEMBL23159186

SCHEMBL23159186

NC(Cc1ccccccccc1)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC7A5 Q01650 4/20 1.00
▸ PTGS1 P23219 2/20 1.00
▸ ALPI P09923 1/20 1.00
▸ PKM P14618 1/20 1.00
▸ XIAP P98170 1/20 1.00
▸ SLC1A3 P43003 2/20 0.69
▸ SLC1A2 P43004 2/20 0.69
▸ SLC1A1 P43005 2/20 0.69
▸ SLC15A1 P46059 1/20 0.63
▸ CYP1A2 P05177 1/20 0.61
▸ LTA4H P09960 1/20 0.59
▸ GRIA2 P42262 1/20 0.59
▸ KDM4E B2RXH2 1/20 0.58
▸ USP2 O75604 1/20 0.58
▸ EGFR P00533 1/20 0.58
▸ LCK P06239 1/20 0.58
▸ FYN P06241 1/20 0.58
▸ ADORA3 P0DMS8 1/20 0.58
▸ ALOX15 P16050 1/20 0.58
▸ HTR2A P28223 1/20 0.58

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
Dl-Phenylalanine SCHEMBL1331077 1.00 SLC7A5 (1.00) SLC7A5PTGS1ALPIPKMXIAP
Phenylalanine SCHEMBL1449128 1.00 SLC7A5 (1.00) SLC7A5PTGS1ALPIPKMXIAP
Dl-Phenylalanine SCHEMBL1332173 1.00 SLC7A5 (1.00) SLC7A5PTGS1ALPIPKMXIAP
Dl-Phenylalanine SCHEMBL288606 1.00 SLC7A5 (1.00) SLC7A5PTGS1ALPIPKMXIAP
Dl-Phenylalanine SCHEMBL1331829 1.00 SLC7A5 (1.00) SLC7A5PTGS1ALPIPKMXIAP
Phenylalanine SCHEMBL8835931 1.00 SLC7A5 (1.00) SLC7A5PTGS1ALPIPKMXIAP
Dl-Phenylalanine SCHEMBL1331777 1.00 SLC7A5 (1.00) SLC7A5PTGS1ALPIPKMXIAP
Dl-Phenylalanine SCHEMBL2785094 1.00 SLC7A5 (1.00) SLC7A5PTGS1ALPIPKMXIAP
Dl-Phenylalanine SCHEMBL1330932 1.00 SLC7A5 (1.00) SLC7A5PTGS1ALPIPKMXIAP
Dl-Phenylalanine SCHEMBL1331205 1.00 SLC7A5 (1.00) SLC7A5PTGS1ALPIPKMXIAP

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-3240799-B1 S-ALKYLATED HEPCIDIN PEPTIDES AND METHODS OF MAKING AND USING THEREOF UNIV CALIFORNIA (US) 2021-03-31 — — EP disclosed
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