SCHEMBL22147415

SCHEMBL22147415

NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccncc1

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 1/20 0.52
▸ AKT1 P31749 1/20 0.49
▸ MMP1 P03956 1/20 0.49
▸ FCER2 P06734 1/20 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
SCHEMBL10049933 0.92 CTSC (0.60) CTSCMMP1FCER2
SCHEMBL29372257 0.92 CTSC (0.60) CTSCMMP1FCER2
SCHEMBL22925587 0.92 CTSC (0.60) CTSCMMP1FCER2
SCHEMBL22649189 0.92 CTSC (0.60) CTSCMMP1FCER2
SCHEMBL29437738 0.85 ACE (0.60) —
SCHEMBL27755089 0.85 ACE (0.60) —
Trifluoroacetic Acid SCHEMBL30164220 0.85 PTPN1 (0.54) CTSCMMP1FCER2
SCHEMBL30995919 0.85 MME (0.55) CTSC
SCHEMBL31289124 0.84 MC4R (0.60) CTSCFCER2
SCHEMBL26254682 0.83 REN (0.51) —

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
WO-2020131283-A1 ANALOGS THAT TARGET MITOCHONDRIAL DISEASES STEALTH BIOTHERAPEUTICS CORP. (MC) 2020-06-25 — — WO disclosed
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