SCHEMBL29802232

SCHEMBL29802232

NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CCN)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SLC15A2 Q16348 1/20 0.55
▸ CALCRL Q16602 2/20 0.41
▸ SLC6A5 Q9Y345 1/20 0.41
▸ FOLH1 Q04609 1/20 0.41
▸ ECE1 P42892 1/20 0.40
▸ ITGB3 P05106 3/20 0.39
▸ ITGA2B P08514 3/20 0.39
▸ F2 P00734 1/20 0.39
▸ GNPAT O15228 1/20 0.38
▸ ERAP2 Q6P179 1/20 0.38
▸ LNPEP Q9UIQ6 1/20 0.38
▸ NMT2 O60551 1/20 0.37
▸ NMT1 P30419 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
SCHEMBL31265389 0.95 SLC15A2 (0.51) SLC15A2CALCRLSLC6A5FOLH1ECE1
SCHEMBL259085 0.93 SLC15A2 (0.64) SLC15A2CALCRLSLC6A5FOLH1ECE1
SCHEMBL5598418 0.93 SLC15A2 (0.64) SLC15A2CALCRLSLC6A5FOLH1ECE1
SCHEMBL259084 0.93 SLC15A2 (0.64) SLC15A2CALCRLSLC6A5FOLH1ECE1
SCHEMBL8832939 0.93 SLC15A2 (0.64) SLC15A2CALCRLSLC6A5FOLH1ECE1
SCHEMBL10595108 0.93 SLC15A2 (0.64) SLC15A2CALCRLSLC6A5FOLH1ECE1
SCHEMBL31265398 0.92 SLC15A2 (0.48) SLC15A2CALCRLSLC6A5ECE1F2
SCHEMBL31265395 0.92 SLC15A2 (0.48) SLC15A2CALCRLSLC6A5ECE1F2
SCHEMBL4589314 0.92 SLC15A2 (0.63) SLC15A2CALCRLSLC6A5FOLH1ECE1
SCHEMBL4589903 0.92 SLC15A2 (0.63) SLC15A2CALCRLSLC6A5FOLH1ECE1

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
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
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