SCHEMBL5967034

SCHEMBL5967034

COC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)Cc1cc(F)cc(F)c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SMYD3 Q9H7B4 1/20 0.49
▸ PEPD P12955 3/20 0.43
▸ GAA P10253 1/20 0.43
▸ PSEN1 P49768 6/20 0.41
▸ PSEN2 P49810 6/20 0.41
▸ APH1B Q8WW43 6/20 0.41
▸ NCSTN Q92542 6/20 0.41
▸ APH1A Q96BI3 6/20 0.41
▸ PSENEN Q9NZ42 6/20 0.41
▸ KCNK3 O14649 1/20 0.41
▸ FKBP1A P62942 2/20 0.40
▸ KLK5 Q9Y337 1/20 0.40
▸ ACE P12821 3/20 0.39
▸ XPNPEP1 Q9NQW7 2/20 0.39
▸ LMNA P02545 1/20 0.39

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
SCHEMBL7401956 0.98 SMYD3 (0.48) SMYD3PEPDGAAPSEN1PSEN2
SCHEMBL5967382 0.97 SMYD3 (0.48) SMYD3PEPDGAAPSEN1PSEN2
SCHEMBL5967094 0.85 ACE (0.52) FKBP1AKLK5ACELMNA
SCHEMBL7401797 0.83 PSEN1 (0.41) SMYD3PSEN1PSEN2APH1BNCSTN
SCHEMBL5967019 0.79 PSEN1 (0.46) SMYD3PSEN1PSEN2APH1BNCSTN
SCHEMBL5967239 0.78 SMYD3 (0.45) SMYD3PSEN1PSEN2APH1BNCSTN
SCHEMBL15692884 0.75 PEPD (0.49) PEPDFKBP1AKLK5ACEXPNPEP1
SCHEMBL18085978 0.75 PREP (0.59) PEPDFKBP1AACEXPNPEP1LMNA
SCHEMBL9814463 0.75 ACE (0.53) FKBP1AKLK5ACELMNA
SCHEMBL18621647 0.74 CCR1 (0.53) KLK5ACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030229024-A1 Methods and compounds for inhibiting beta-amyloid peptide release and/or its synthesis AUDIA JAMES E (US) 2003-12-11 — — US claimed
US-20020052322-A1 Methods and compounds for inhibiting beta-amyloid peptide release and/or its synthesis ELAN PHARMACEUTICALS, INC. 2002-05-02 — — US claimed
US-6207710-B1 FOR THERAPY OF ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. 2001-03-27 — — US claimed
US-6191166-B1 ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. 2001-02-20 — — US claimed
US-20060223761-A1 Methods and compounds for inhibiting beta-amyloid peptide release and/or its synthesis ELAN PHARMACEUTICALS, INC. (US) 2006-10-05 — — US disclosed
US-6888022-B2 Methods and compounds for inhibiting β-amyloid peptide release and/or its synthesis ATHENA NEUROSCIENCES, INC. (US) 2005-05-03 — — US disclosed
US-6861558-B2 Methods and compounds for inhibiting β-amyloid peptide release and/or its synthesis ELAN PHARMACEUTICALS, INC. (US) 2005-03-01 — — US disclosed
US-20030229024-A1 Methods and compounds for inhibiting beta-amyloid peptide release and/or its synthesis AUDIA JAMES E (US) 2003-12-11 — — US disclosed
US-6476263-B1 Compounds for inhibiting β-amyloid peptide release and/or its synthesis ELAN PHARMACEUTICALS, INC. 2002-11-05 — — US disclosed
US-20020052322-A1 Methods and compounds for inhibiting beta-amyloid peptide release and/or its synthesis ELAN PHARMACEUTICALS, INC. 2002-05-02 — — US disclosed
US-6211235-B1 ALZHEIMERS DISEASE ELAN PHARMACEUTICALS, INC. 2001-04-03 — — US disclosed
US-6207710-B1 FOR THERAPY OF ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. 2001-03-27 — — US disclosed
US-6191166-B1 ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. 2001-02-20 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020052322-A1 Methods and compounds for inhibiting beta-amyloid peptide release and/or its synthesis APP, BACE1, IAPP SMYD3 4198/4885PEPD 32/4885GAA 25/4885
US-20060223761-A1 Methods and compounds for inhibiting beta-amyloid peptide release and/or its synthesis APP, BACE1, IAPP SMYD3 4183/4885PEPD 35/4885GAA 23/4885
US-20030229024-A1 Methods and compounds for inhibiting beta-amyloid peptide release and/or its synthesis APP, BACE1, IAPP SMYD3 4198/4885PEPD 32/4885GAA 25/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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