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SCHEMBL22117437

SCHEMBL22117437

N=C(N)NCCC[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)O)C(=O)N[C@@H](CC1CCOCC1)C(=O)N[C@@H](CCCCNC(=O)OCc1ccccc1)C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.50
▸ NPY4R P50391 7/20 0.45
▸ PTGER4 P35408 4/20 0.45
▸ NPY1R P25929 4/20 0.45
▸ NPY2R P49146 3/20 0.45
▸ NPY5R Q15761 3/20 0.45
▸ SIRT2 Q8IXJ6 1/20 0.43
▸ REN P00797 1/20 0.42

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
SCHEMBL22117438 1.00 CTSL (0.50) CTSLNPY4RPTGER4NPY1RNPY2R
SCHEMBL31679033 0.93 CTSL (0.48) CTSLNPY4RPTGER4NPY1RNPY2R
SCHEMBL31679021 0.92 KLK7 (0.51) CTSLNPY4R
SCHEMBL22117554 0.92 SIRT2 (0.49) CTSLPTGER4SIRT2
SCHEMBL22117555 0.92 SIRT2 (0.49) CTSLPTGER4SIRT2
SCHEMBL28652336 0.91 CTSL (0.45) CTSLNPY4RPTGER4NPY1RNPY2R
SCHEMBL28652331 0.91 CTSL (0.45) CTSLNPY4RPTGER4NPY1RNPY2R
SCHEMBL22117436 0.89 CTSL (0.45) CTSLPTGER4SIRT2REN
SCHEMBL22117540 0.86 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5R
SCHEMBL22117542 0.86 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3898652-A1 MITOCHONDRIA-TARGETING PEPTIDES Stealth Biotherapeutics Corp (MC) 2021-10-27 — — EP disclosed
WO-2020131282-A1 MITOCHONDRIA-TARGETING PEPTIDES STEALTH BIOTHERAPEUTICS CORP. (MC) 2020-06-25 — — WO disclosed
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