SCHEMBL29870996

SCHEMBL29870996

NCCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SLC15A2 Q16348 1/20 0.44
▸ NAALAD2 Q9Y3Q0 5/20 0.39
▸ HPGD P15428 2/20 0.39
▸ FOLH1 Q04609 4/20 0.39
▸ MME P08473 1/20 0.39
▸ ECE1 P42892 1/20 0.39
▸ GART P22102 4/20 0.37
▸ RIMKLA Q8IXN7 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ GNPAT O15228 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ MMP1 P03956 1/20 0.36
▸ MMP8 P22894 1/20 0.36
▸ TYMS P04818 1/20 0.36
▸ ATIC P31939 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
SCHEMBL31265388 1.00 SLC15A2 (0.44) SLC15A2NAALAD2HPGDFOLH1MME
SCHEMBL31265389 0.94 SLC15A2 (0.51) SLC15A2FOLH1ECE1GNPAT
SCHEMBL7807950 0.92 SLC15A2 (0.49) SLC15A2NAALAD2HPGDFOLH1MME
SCHEMBL28382211 0.92 SLC15A2 (0.43) SLC15A2MME
SCHEMBL31265384 0.92 SLC15A2 (0.38) SLC15A2HPGDMMEECE1
SCHEMBL29802232 0.90 SLC15A2 (0.55) SLC15A2FOLH1ECE1GNPAT
SCHEMBL31265396 0.90 MME (0.40) SLC15A2MMEECE1
SCHEMBL29871668 0.89 GLP1R (0.39) SLC15A2
SCHEMBL31139543 0.88 SLC15A2 (0.58) SLC15A2FOLH1ECE1
Carnosine SCHEMBL33768 0.87 ITGB3 (0.41) SLC15A2

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-114945579-B Heme derivative and preparation method and application thereof 吉林省澳宇生物科技有限公司 2025-01-21 — — CN disclosed
CN-114945579-A Heme derivatives, their preparation and use 吉林省澳宇生物科技有限公司 2022-08-26 — — CN disclosed
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