SCHEMBL30879458

SCHEMBL30879458

CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)CC)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCNC(=N)N)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 1/20 0.47
▸ ENPEP Q07075 5/20 0.47
▸ RXFP1 Q9HBX9 1/20 0.47
▸ VIPR2 P41587 6/20 0.47
▸ VIPR1 P32241 4/20 0.47
▸ TASP1 Q9H6P5 1/20 0.46
▸ ECE1 P42892 1/20 0.44
▸ GLP1R P43220 1/20 0.44
▸ MUS81 Q96NY9 1/20 0.44
▸ NPY4R P50391 4/20 0.44
▸ NPY1R P25929 3/20 0.44
▸ NPY2R P49146 3/20 0.44
▸ NPY5R Q15761 3/20 0.44

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
SCHEMBL30483972 0.98 ENPEP (0.49) BACE1ENPEPRXFP1VIPR2VIPR1
SCHEMBL30879453 0.95 NPY4R (0.48) BACE1ENPEPRXFP1VIPR2VIPR1
SCHEMBL30483984 0.95 RXFP1 (0.46) BACE1ENPEPRXFP1VIPR2VIPR1
SCHEMBL30912040 0.94 RXFP1 (0.50) BACE1ENPEPRXFP1VIPR2VIPR1
SCHEMBL30912039 0.94 RXFP1 (0.50) BACE1ENPEPRXFP1VIPR2VIPR1
SCHEMBL30912047 0.94 RXFP1 (0.49) BACE1ENPEPRXFP1VIPR2VIPR1
SCHEMBL30912045 0.90 NPY4R (0.49) RXFP1VIPR2VIPR1NPY4RNPY1R
SCHEMBL30912041 0.89 RXFP1 (0.48) BACE1RXFP1VIPR2VIPR1TASP1
SCHEMBL30912048 0.89 RXFP1 (0.50) BACE1RXFP1VIPR2VIPR1NPY4R
SCHEMBL31318575 0.89 VIPR1 (0.53) BACE1RXFP1VIPR2VIPR1TASP1

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
US-20240181015-A1 EFFECT OF GHRH ANTAGONISTS IN DIABETES AND OBESITY AUGUSTA UNIVERSITY RESEARCH INSTITUTE, INC. (US) 2024-06-06 — — US disclosed
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