SCHEMBL2432660

SCHEMBL2432660

C[C@@H]1C[C@]2(CCC(=O)N2c2cccc(F)c2)CCN1Cc1c[nH]c2ccc(C#N)cc12

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.44
DRD4 P21917 4/20 0.44
DRD3 P35462 4/20 0.44
BACE1 P56817 9/20 0.42
SLC6A4 P31645 5/20 0.39
SLC6A3 Q01959 1/20 0.38

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
SCHEMBL2434465 0.89 BACE1 (0.46) BACE1
SCHEMBL2434388 0.86 BACE1 (0.46) DRD4BACE1
SCHEMBL2439264 0.86 DRD2 (0.44) DRD2DRD4DRD3BACE1SLC6A4
SCHEMBL1170623 0.83 BACE1 (0.63) BACE1
SCHEMBL2438146 0.82 BACE1 (0.42) DRD2DRD4DRD3BACE1
SCHEMBL1170621 0.81 BACE1 (0.52) DRD2DRD4DRD3BACE1
SCHEMBL2438577 0.76 BACE1 (0.69) BACE1
SCHEMBL2434035 0.76 BACE1 (0.39) BACE1
SCHEMBL2433017 0.76 BACE1 (0.45) BACE1
SCHEMBL2438454 0.74 BACE1 (0.45) BACE1

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-20110224231-A1 Novel Lactams as Beta Secretase Inhibitors PFIZER INC. (US) 2011-09-15 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 (1 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-20110224231-A1 Novel Lactams as Beta Secretase Inhibitors BACE1, BACE2, APH1B DRD2 4398/4885DRD4 4536/4885DRD3 4408/4885

“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.