SCHEMBL2373394

SCHEMBL2373394

CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 12/20 0.48
▸ ENPEP Q07075 5/20 0.45
▸ CTSD P07339 2/20 0.42
▸ DPP4 P27487 1/20 0.41
▸ DPP8 Q6V1X1 1/20 0.41
▸ DPP9 Q86TI2 1/20 0.41
▸ BACE2 Q9Y5Z0 1/20 0.40

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
SCHEMBL2373402 0.93 BACE1 (0.47) BACE1ENPEPCTSDDPP4DPP8
SCHEMBL31514375 0.93 BACE1 (0.47) BACE1ENPEPCTSDDPP4DPP8
SCHEMBL30051929 0.89 ENPEP (0.44) ENPEP
SCHEMBL29931588 0.88 ENPEP (0.53) BACE1ENPEP
SCHEMBL29931628 0.88 ENPEP (0.53) BACE1ENPEP
SCHEMBL873467 0.88 BACE1 (0.50) BACE1ENPEPCTSDBACE2
SCHEMBL29544537 0.88 DPP4 (0.47) BACE1DPP4DPP8DPP9BACE2
SCHEMBL30051938 0.88 ENPEP (0.45) BACE1ENPEP
SCHEMBL11886063 0.86 ENPEP (0.54) BACE1ENPEPCTSDDPP4DPP8
SCHEMBL29458837 0.86 ENPEP (0.54) BACE1ENPEPCTSDDPP4DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3371238-A1 THERMOFORMABLE DUAL NETWORK HYDROGEL COMPOSITIONS Lubrizol Advanced Materials, Inc. (US) 2018-09-12 — — EP disclosed
WO-2017079248-A1 THERMOFORMABLE DUAL NETWORK HYDROGEL COMPOSITIONS LUBRIZOL ADVANCED MATERIALS, INC. (US) 2017-05-11 — — WO disclosed
EP-2549977-A2 LIPID NANOPARTICLE CAPSULES Lipotec, S.A. (ES) 2013-01-30 — — EP disclosed
EP-2550391-A1 PROCESS OF TREATMENT OF FIBERS AND/OR TEXTILE MATERIALS Lipotec, S.A. (ES) 2013-01-30 — — EP disclosed
WO-2011116963-A2 LIPID NANOPARTICLE CAPSULES LIPOTEC S.A. (ES) 2011-09-29 — — WO disclosed
WO-2011116962-A1 PROCESS OF TREATMENT OF FIBERS AND/OR TEXTILE MATERIALS LIPOTEC S.A. (ES) 2011-09-29 — — WO disclosed
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