SCHEMBL30844023

SCHEMBL30844023

C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ OPRK1 P41145 2/20 0.42
▸ CDYL2 Q8N8U2 1/20 0.38
▸ CDYL Q9Y232 1/20 0.38
▸ HDAC3 O15379 10/20 0.38
▸ HDAC11 Q96DB2 10/20 0.38
▸ HDAC6 Q9UBN7 10/20 0.38
▸ HDAC1 Q13547 9/20 0.38
▸ HDAC2 Q92769 9/20 0.38
▸ HDAC10 Q969S8 9/20 0.38
▸ HDAC8 Q9BY41 9/20 0.38
▸ NCOR2 Q9Y618 3/20 0.38
▸ HDAC4 P56524 1/20 0.37
▸ HDAC7 Q8WUI4 1/20 0.37
▸ HDAC9 Q9UKV0 1/20 0.37
▸ HDAC5 Q9UQL6 1/20 0.37
▸ STAT3 P40763 4/20 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
SCHEMBL29713552 0.89 OPRK1 (0.46) OPRK1HDAC3HDAC11HDAC6HDAC1
SCHEMBL29416863 0.89 OPRK1 (0.46) OPRK1HDAC3HDAC11HDAC6HDAC1
SCHEMBL159688 0.81 OPRK1 (0.44) OPRK1HDAC3HDAC11HDAC6HDAC1
SCHEMBL159687 0.81 OPRK1 (0.44) OPRK1HDAC3HDAC11HDAC6HDAC1
SCHEMBL27905689 0.81 OPRK1 (0.44) OPRK1HDAC3HDAC11HDAC6HDAC1
SCHEMBL31199140 0.79 OPRK1 (0.41) OPRK1HDAC3HDAC11HDAC6HDAC1
SCHEMBL30112831 0.78 DPP7 (0.41) CDYL2CDYLSTAT3
SCHEMBL31061201 0.78 OPRK1 (0.45) OPRK1HDAC3HDAC11HDAC6HDAC1
SCHEMBL11246319 0.77 OPRK1 (0.49) OPRK1HDAC3HDAC11HDAC6HDAC1
SCHEMBL31257033 0.77 MEN1 (0.47) CDYL2CDYL

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250268291-A1 FLAVOR COMPOSITIONS AND SCREENING METHODS FOR IDENTIFYING THE SAME MARS, INCORPORATED (US) 2025-08-28 — — US claimed
EP-3768092-B1 FLAVOR COMPOSITIONS AND METHODS FOR PREPARING THE SAME MARS INC (US) 2024-10-02 — — EP claimed
CN-112533485-B Flavor composition and screening method for identifying flavor composition 马斯公司 2024-04-12 — — CN claimed
US-20250268291-A1 FLAVOR COMPOSITIONS AND SCREENING METHODS FOR IDENTIFYING THE SAME MARS, INCORPORATED (US) 2025-08-28 — — US disclosed
US-12317911-B2 Flavor compositions and screening methods for identifying the same MARS, INCORPORATED (US) 2025-06-03 — — US disclosed
EP-3768092-B1 FLAVOR COMPOSITIONS AND METHODS FOR PREPARING THE SAME MARS INC (US) 2024-10-02 — — EP disclosed
CN-112533485-B Flavor composition and screening method for identifying flavor composition 马斯公司 2024-04-12 — — CN disclosed
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