SCHEMBL29014876

SCHEMBL29014876

C[C@@H](O)[C@H](NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SLC15A2 Q16348 1/20 0.63
▸ CCNA2 P20248 2/20 0.49
▸ CDK2 P24941 2/20 0.49
▸ CCNA1 P78396 2/20 0.49
▸ CPB2 Q96IY4 1/20 0.48
▸ GHSR Q92847 7/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ SLC7A5 Q01650 1/20 0.48

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
SCHEMBL27706632 0.91 SLC15A2 (0.74) SLC15A2CPB2GHSRCYP3A4SLC7A5
SCHEMBL30911281 0.91 SLC15A2 (0.74) SLC15A2CPB2GHSRCYP3A4SLC7A5
SCHEMBL22217022 0.83 SLC15A2 (0.79) SLC15A2CPB2GHSRCYP3A4SLC7A5
SCHEMBL29774690 0.83 SLC15A2 (0.72) SLC15A2CCNA2CDK2CCNA1CPB2
SCHEMBL29774683 0.83 SLC15A2 (0.72) SLC15A2CCNA2CDK2CCNA1CPB2
SCHEMBL30409074 0.82 SLC15A2 (0.71) SLC15A2CPB2GHSRCYP3A4SLC7A5
SCHEMBL28027302 0.82 SLC15A2 (0.71) SLC15A2CPB2GHSRCYP3A4SLC7A5
SCHEMBL28457067 0.81 SLC15A2 (0.76) SLC15A2CPB2GHSRCYP3A4SLC7A5
SCHEMBL31472587 0.81 SLC15A2 (0.42) SLC15A2CPB2
SCHEMBL29014883 0.81 SLC15A2 (0.42) SLC15A2CPB2

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-116087353-A Metabolic identification method for wild cordyceps sinensis and substitute thereof 武汉大学中南医院 2023-05-09 — — CN claimed
CN-116087353-A Metabolic identification method for wild cordyceps sinensis and substitute thereof 武汉大学中南医院 2023-05-09 — — CN disclosed
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