SCHEMBL7367655

SCHEMBL7367655

CCOC(=O)C(NC(=O)[C@H](C)NC(=O)Cc1cc(F)cc(F)c1)c1ccncc1.COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)CC1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PSEN1 P49768 3/20 0.48
▸ PSEN2 P49810 3/20 0.48
▸ APH1B Q8WW43 3/20 0.48
▸ NCSTN Q92542 3/20 0.48
▸ APH1A Q96BI3 3/20 0.48
▸ PSENEN Q9NZ42 3/20 0.48
▸ YAP1 P46937 11/20 0.44
▸ IL2RA P01589 1/20 0.38
▸ ALB P02768 1/20 0.38
▸ IL2 P60568 1/20 0.38
▸ REN P00797 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL5967164 0.82 PSEN1 (0.42) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5966814 0.80 ALDH1A1 (0.56) YAP1IL2RAALBIL2REN
SCHEMBL5966867 0.79 ALDH1A1 (0.44) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5966773 0.79 ALDH1A1 (0.57) YAP1IL2RAALBIL2ATM
SCHEMBL27563567 0.79 ALDH1A1 (0.57) RENATM
SCHEMBL5967052 0.79 ALDH1A1 (0.57) RENATM
SCHEMBL7368509 0.78 YAP1 (0.50) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7372329 0.78 PSEN1 (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5967327 0.76 ALDH1A1 (0.59) YAP1ATM
SCHEMBL5966784 0.75 PSEN1 (0.68) PSEN1PSEN2APH1BNCSTNAPH1A

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
EP-0942924-A2 METHODS AND COMPOUNDS FOR INHIBITING $g(b)-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS Elan Pharmaceuticals, Inc. (US) 1999-09-22 — — EP claimed
WO-1998022494-A9 METHODS AND COMPOUNDS FOR INHIBITING β-AMYLOID PEPTIDE RELEASE AND/OR SYNTHESIS — 1998-08-20 — — WO claimed
WO-1998022494-A2 METHODS AND COMPOUNDS FOR INHIBITING β-AMYLOID PEPTIDE RELEASE AND/OR SYNTHESIS ELAN PHARMACEUTICALS, INC. (US) 1998-05-28 — — WO claimed
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