SCHEMBL4906856

SCHEMBL4906856

CN1C(=O)C(c2ccc(OS(=O)(=O)c3c(Cl)nc4sccn34)cc2)(c2ccc(F)c(Br)c2)NC1=S

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 11/20 0.32
CCKBR P32239 1/20 0.31
MET P08581 4/20 0.31
CNR1 P21554 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2A6 P11509 1/20 0.30
HTR2C P28335 1/20 0.30
HTR7 P34969 1/20 0.30
HTR2B P41595 1/20 0.30
ACLY P53396 1/20 0.30

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
SCHEMBL4910195 0.94 HTR6 (0.33) HTR6CCKBRMETCYP3A4CYP2A6
SCHEMBL4906492 0.81 BACE1 (0.41) CYP3A4
SCHEMBL4524137 0.78 CNR1 (0.40) CNR1
SCHEMBL4737186 0.77 CNR1 (0.38) CNR1
SCHEMBL4914076 0.77 CNR1 (0.36) HTR6CNR1
SCHEMBL4913370 0.77 CNR1 (0.33) CNR1
SCHEMBL4919290 0.77 BACE1 (0.45)
SCHEMBL4916542 0.77 GAA (0.38) CNR1
SCHEMBL4915885 0.75 CNR1 (0.34) CNR1
SCHEMBL4914432 0.74 MAPT (0.44) CNR1

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-20080176862-A1 Cognitive impairment, Alzheimer disease, neurodegeneration, dementia; such as 3'-(2-amino-4-(2-chloropyridin-4-yl)-1-methyl-5-oxo-4,5-dihydro-1H-imidazol-4-yl)-5-chlorobiphenyl-3-yl methanesulfonate; Beta site APP Cleaving Enzyme (BACE) inhibitors ASTRAZENECA AB (SE) 2008-07-24 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-20080176862-A1 Cognitive impairment, Alzheimer disease, neurodegeneration, dementia; such as 3'-(2-amino-4-(2-chloropyridin-4-yl)-1-methyl-5-oxo-4,5-dihydro-1H-imidazol-4-yl)-5-chlorobiphenyl-3-yl methanesulfonate; Beta site APP Cleaving Enzyme (BACE) inhibitors BACE1, BACE2, PSEN1 HTR6 1872/4885CCKBR 1437/4885MET 1723/4885

“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.