SCHEMBL31265389

SCHEMBL31265389

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

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SLC15A2 Q16348 1/20 0.51
▸ FOLH1 Q04609 7/20 0.47
▸ CALCRL Q16602 2/20 0.40
▸ ECE1 P42892 1/20 0.40
▸ SLC6A5 Q9Y345 1/20 0.38
▸ GNPAT O15228 1/20 0.37
▸ ACE P12821 1/20 0.37
▸ F2 P00734 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
SCHEMBL29802232 0.95 SLC15A2 (0.55) SLC15A2FOLH1CALCRLECE1SLC6A5
SCHEMBL31139543 0.94 SLC15A2 (0.58) SLC15A2FOLH1CALCRLECE1SLC6A5
SCHEMBL29870996 0.94 SLC15A2 (0.44) SLC15A2FOLH1ECE1GNPAT
SCHEMBL31265388 0.94 SLC15A2 (0.44) SLC15A2FOLH1ECE1GNPAT
SCHEMBL31265386 0.93 SLC15A2 (0.45) SLC15A2FOLH1F2
SCHEMBL31265393 0.92 SLC15A2 (0.45) SLC15A2FOLH1F2
SCHEMBL30716920 0.91 SLC6A5 (0.52) SLC15A2FOLH1SLC6A5
SCHEMBL29557424 0.90 SLC15A2 (0.43) SLC15A2FOLH1F2
SCHEMBL29473319 0.89 SLC15A2 (0.63) SLC15A2FOLH1CALCRLECE1SLC6A5
SCHEMBL29687923 0.88 SLC15A2 (0.48) SLC15A2FOLH1ECE1

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
Send feedback