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SCHEMBL4464636

SCHEMBL4464636

CCCCCCCC(=O)N(C(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CN)[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 3/20 0.54
▸ F2 P00734 4/20 0.52
▸ GHSR Q92847 3/20 0.49

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
SCHEMBL5068397 0.95 F2 (0.54) APLNRF2GHSR
SCHEMBL7053513 0.92 NMUR2 (0.47) APLNRF2
SCHEMBL5059932 0.90 APLNR (0.64) APLNRF2GHSR
SCHEMBL4459179 0.90 APLNR (0.63) APLNRF2GHSR
SCHEMBL16150700 0.89 APLNR (0.64) APLNRGHSR
SCHEMBL5068412 0.87 APLNR (0.60) APLNRGHSR
SCHEMBL5554051 0.85 ACE (0.48) —
SCHEMBL30166497 0.83 APLNR (0.62) APLNRGHSR
SCHEMBL6955243 0.83 F2 (0.55) APLNRF2GHSR
SCHEMBL7619215 0.83 NMUR2 (0.58) APLNR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009040047-A2 THERAPEUTIC USES OF GHRELIN AND COMBINATIONS WITH STRESSCOPIN MONDOBIOTECH LABORATORIES AG (LI) 2009-04-02 — — WO claimed
US-20230346889-A9 TREATMENT OF ACUTE HEART FAILURE AnaCardio R&D AB (SE) 2023-11-02 — — US disclosed
US-20230126295-A1 TREATMENT OF ACUTE HEART FAILURE AnaCardio R&D AB (SE) 2023-04-27 — — US disclosed
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