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SCHEMBL11568489

SCHEMBL11568489

CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)OCc1ccccc1)C(C)C)C(=O)OC(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CTSD P07339 5/20 0.45
▸ CTSK P43235 3/20 0.44
▸ CTSB P07858 1/20 0.44
▸ BACE1 P56817 6/20 0.43
▸ PSEN1 P49768 3/20 0.42
▸ PSEN2 P49810 3/20 0.42
▸ APH1B Q8WW43 3/20 0.42
▸ NCSTN Q92542 3/20 0.42
▸ APH1A Q96BI3 3/20 0.42
▸ PSENEN Q9NZ42 3/20 0.42
▸ REN P00797 1/20 0.41

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
SCHEMBL11567621 0.87 CTSK (0.55) CTSDCTSKCTSB
SCHEMBL11567622 0.87 CTSK (0.55) CTSDCTSKCTSB
Hydrochloric Acid SCHEMBL11568557 0.86 CTSK (0.54) CTSDCTSKCTSB
Hydrochloric Acid SCHEMBL11568559 0.86 CTSK (0.54) CTSDCTSKCTSB
SCHEMBL11568405 0.85 MME (0.50) CTSDCTSKCTSB
SCHEMBL11568394 0.85 MME (0.50) CTSDCTSKCTSB
SCHEMBL11567669 0.81 CTSK (0.53) CTSKCTSBBACE1PSEN1PSEN2
SCHEMBL7059168 0.79 SLC1A3 (0.46) —
SCHEMBL9841920 0.79 SLC1A3 (0.46) —
SCHEMBL11569823 0.79 BACE1 (0.52) BACE1PSEN1PSEN2APH1BNCSTN

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
US-4146614-A TREATMENT OF SCHIZOPHRENIA STATE OF MICHIGAN (US) 1979-03-27 — — US disclosed