SCHEMBL30046015

SCHEMBL30046015

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ EDNRA P25101 1/20 0.62
▸ CCKBR P32239 5/20 0.53
▸ IL23R Q5VWK5 2/20 0.51
▸ KEAP1 Q14145 1/20 0.50
▸ RXFP1 Q9HBX9 1/20 0.50
▸ MAGI3 Q5TCQ9 1/20 0.49
▸ PTH1R Q03431 1/20 0.49
▸ KISS1R Q969F8 4/20 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
SCHEMBL30045143 0.97 EDNRA (0.57) EDNRACCKBRMAGI3
SCHEMBL30045690 0.94 CCKBR (0.60) EDNRACCKBR
SCHEMBL30046082 0.94 EDNRA (0.69) EDNRACCKBRMAGI3KISS1R
SCHEMBL30999648 0.91 CCKBR (0.62) CCKBR
SCHEMBL30045692 0.89 EDNRA (0.60) EDNRACCKBRKEAP1PTH1R
SCHEMBL30533189 0.89 EDNRA (0.73) EDNRAMAGI3KISS1R
SCHEMBL30533188 0.87 EDNRA (0.73) EDNRACCKBRMAGI3KISS1R
SCHEMBL30044915 0.86 EDNRA (0.56) EDNRACCKBRKEAP1MAGI3PTH1R
SCHEMBL30533182 0.86 EDNRA (0.71) EDNRAMAGI3
SCHEMBL30045122 0.86 EDNRA (0.55) EDNRACCKBRKEAP1MAGI3PTH1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11634458-B2 Peptides and compositions for use in cosmetics and medicine LIPOTRUE, S.L. (ES) 2023-04-25 — — US claimed
EP-3758730-B1 PEPTIDES AND COMPOSITIONS FOR USE IN COSMETICS AND MEDICINE LIPOTRUE S L (ES) 2022-11-02 — — EP claimed
US-11634458-B2 Peptides and compositions for use in cosmetics and medicine LIPOTRUE, S.L. (ES) 2023-04-25 — — US disclosed
EP-3758730-B1 PEPTIDES AND COMPOSITIONS FOR USE IN COSMETICS AND MEDICINE LIPOTRUE S L (ES) 2022-11-02 — — EP disclosed
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