SCHEMBL4811294

SCHEMBL4811294

COCCSC(C(=O)NCc1ccccc1)C(O)C(N)Cc1cc(F)cc(F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA3 P07451 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CACNA1C Q13936 1/20 0.41
CA9 Q16790 1/20 0.41
CA13 Q8N1Q1 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
BACE1 P56817 2/20 0.41
BACE2 Q9Y5Z0 2/20 0.41
CTSD P07339 1/20 0.37
KMT2A Q03164 2/20 0.37
CYP2D6 P10635 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL4816793 0.85 BACE1 (0.38) BACE1BACE2LAP3ANPEPRNPEP
SCHEMBL4818604 0.81 LAP3 (0.46) BACE1CTSDKMT2AMEN1LAP3
SCHEMBL4814036 0.76 BACE1 (0.66) BACE1BACE2CTSD
SCHEMBL14194523 0.76 BACE1 (0.66) BACE1BACE2CTSD
SCHEMBL8361397 0.76 BACE1 (0.39) BACE1BACE2CTSD
SCHEMBL4811289 0.73 SCN9A (0.38) SCN9ACA12CA1CA2CA3
SCHEMBL4812286 0.72 SCN9A (0.37) SCN9ACA12CA1CA2CA3
SCHEMBL14577806 0.72 MASP2 (0.48) BACE1BACE2KMT2ALAP3CYP3A4
SCHEMBL3356614 0.72 MASP2 (0.48) BACE1BACE2KMT2ALAP3CYP3A4
SCHEMBL13333829 0.72 MASP2 (0.48) BACE1BACE2KMT2ALAP3CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7354943-B2 Statine derivatives for the treatment of Alzheimer's disease PHARMACIA & UPJOHN (US) 2008-04-08 US claimed
US-20050165069-A1 Statine derivatives for the treatment of Alzheimer's disease ALZHEIMER'S COLLABORATION 2005-07-28 US claimed
US-20050159459-A1 Statine derivatives for the treatment of Alzheimer's disease ALZHEIMER'S COLLABORATION 2005-07-21 US claimed
US-20030083356-A1 Statine derivatives for the treatment of Alzheimer's disease PHARMACIA & UPJOHN 2003-05-01 US claimed
US-7358264-B2 Statine derivatives for the treatment of Alzheimer's disease PHARMACIA & UPJOHN COMPANY (US) 2008-04-15 US disclosed
US-7354943-B2 Statine derivatives for the treatment of Alzheimer's disease PHARMACIA & UPJOHN (US) 2008-04-08 US disclosed
US-20050165069-A1 Statine derivatives for the treatment of Alzheimer's disease ALZHEIMER'S COLLABORATION 2005-07-28 US disclosed
US-20050159459-A1 Statine derivatives for the treatment of Alzheimer's disease ALZHEIMER'S COLLABORATION 2005-07-21 US disclosed
US-6864290-B2 Statine derivatives for the treatment of Alzheimer's disease PHARMACIA & UPJOHN, LLP (US) 2005-03-08 US disclosed
US-20030083356-A1 Statine derivatives for the treatment of Alzheimer's disease PHARMACIA & UPJOHN 2003-05-01 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-20050165069-A1 Statine derivatives for the treatment of Alzheimer's disease BACE1, APP, BACE2 SCN9A 2355/4885CA12 2761/4885CA1 679/4885
US-20050159459-A1 Statine derivatives for the treatment of Alzheimer's disease BACE1, APP, BACE2 SCN9A 2355/4885CA12 2761/4885CA1 679/4885
US-20030083356-A1 Statine derivatives for the treatment of Alzheimer's disease BACE1, APP, BACE2 SCN9A 2386/4885CA12 2766/4885CA1 477/4885

“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.