SCHEMBL30304710

SCHEMBL30304710

CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.53
▸ KDM1A O60341 3/20 0.53
▸ EPHA2 P29317 2/20 0.51
▸ CMA1 P23946 1/20 0.49
▸ MAOB P27338 1/20 0.49
▸ KDM5A P29375 1/20 0.49
▸ KDM1B Q8NB78 1/20 0.49
▸ REN P00797 6/20 0.48
▸ OPRM1 P35372 2/20 0.48
▸ OPRD1 P41143 1/20 0.48
▸ ANPEP P15144 1/20 0.46
▸ LNPEP Q9UIQ6 1/20 0.46

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
SCHEMBL30304746 0.95 SLC6A2 (0.60) SLC6A2KDM1AEPHA2MAOBKDM5A
SCHEMBL30304772 0.94 EPHA2 (0.55) SLC6A2KDM1AEPHA2CMA1MAOB
SCHEMBL30304751 0.90 SLC6A2 (0.61) SLC6A2KDM1AEPHA2MAOBKDM5A
SCHEMBL29876129 0.87 CALCRL (0.54) SLC6A2KDM1AEPHA2CMA1REN
SCHEMBL29590343 0.86 SLC6A2 (0.57) SLC6A2KDM1ARENOPRM1OPRD1
SCHEMBL29591787 0.85 SLC6A2 (0.55) SLC6A2KDM1AEPHA2MAOBKDM5A
SCHEMBL30844411 0.85 KDM1A (0.56) SLC6A2KDM1AEPHA2MAOBKDM5A
SCHEMBL30051241 0.84 REN (0.55) SLC6A2CMA1REN
SCHEMBL29590910 0.84 SLC6A2 (0.56) SLC6A2KDM1ARENOPRM1OPRD1
SCHEMBL31362679 0.84 SLC6A2 (0.56) SLC6A2RENOPRM1OPRD1

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-116063379-B EphA2 targeting polypeptides and uses thereof 中国药科大学 2025-05-02 — — CN disclosed
CN-116063379-A EphA2 targeting polypeptides and uses thereof 中国药科大学 2023-05-05 — — CN disclosed
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