SCHEMBL30045857

SCHEMBL30045857

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

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EDNRA P25101 1/20 0.68
▸ ERAP2 Q6P179 5/20 0.55
▸ MMP2 P08253 3/20 0.51
▸ MMP8 P22894 2/20 0.51
▸ MMP1 P03956 2/20 0.51
▸ MMP9 P14780 1/20 0.51
▸ ECE1 P42892 5/20 0.50
▸ GLP1R P43220 4/20 0.50
▸ ERAP1 Q9NZ08 4/20 0.50
▸ IL1RN P18510 3/20 0.50
▸ CASP1 P29466 1/20 0.48
▸ CASP3 P42574 1/20 0.48
▸ CASP4 P49662 1/20 0.48
▸ CASP5 P51878 1/20 0.48
▸ CASP7 P55210 1/20 0.48
▸ CASP9 P55211 1/20 0.48
▸ CASP6 P55212 1/20 0.48
▸ CASP8 Q14790 1/20 0.48
▸ CASP10 Q92851 1/20 0.48
▸ KMT2A Q03164 1/20 0.47

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
SCHEMBL7996597 0.99 EDNRA (0.67) EDNRAERAP2MMP2MMP8MMP1
SCHEMBL7996606 0.99 EDNRA (0.67) EDNRAERAP2MMP2MMP8MMP1
SCHEMBL30533172 0.96 EDNRA (0.61) EDNRAERAP2MMP2MMP8MMP1
SCHEMBL7261793 0.95 EDNRA (0.65) EDNRAERAP2MMP2MMP8MMP1
SCHEMBL7261791 0.95 EDNRA (0.65) EDNRAERAP2MMP2MMP8MMP1
SCHEMBL30533194 0.94 EDNRA (0.60) EDNRAERAP2GLP1R
SCHEMBL30045692 0.94 EDNRA (0.60) EDNRAERAP2ECE1GLP1RERAP1
SCHEMBL30533164 0.92 EDNRA (0.59) EDNRAERAP2MMP2MMP8MMP1
SCHEMBL30533198 0.92 EDNRA (0.57) EDNRAERAP2ECE1GLP1RCASP1
SCHEMBL30044915 0.91 EDNRA (0.56) EDNRAERAP2GLP1RCASP1CASP3

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
US-11634458-B2 Peptides and compositions for use in cosmetics and medicine LIPOTRUE, S.L. (ES) 2023-04-25 — — US disclosed
CN-112040969-B Peptides and compositions for use in cosmetics and medicine 利波特鲁有限公司 2023-03-14 — — CN 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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