SCHEMBL4913352

SCHEMBL4913352

CN1C(=O)C(c2cccc(OS(=O)(=O)c3ccc4c(c3)oc(=O)n4C)c2)(c2ccc(F)c(Br)c2)NC1=S

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PKM P14618 9/20 0.38
LMNA P02545 3/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 3/20 0.37
MEN1 O00255 6/20 0.37
KMT2A Q03164 6/20 0.37
PSMD14 O00487 1/20 0.37
ATM Q13315 1/20 0.35
POLB P06746 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL4912002 0.93 TSHR (0.39) PKMLMNATP53TSHRMEN1
SCHEMBL4783917 0.86 PKM (0.38) PKMLMNATP53TSHRMEN1
SCHEMBL4784960 0.85 ALDH1A1 (0.37) MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL4914556 0.83 ALOX15 (0.34) LMNASMN1; SMN2ALDH1A1
SCHEMBL4919313 0.82 CNR1 (0.34)
SCHEMBL4906605 0.82 BACE1 (0.45)
SCHEMBL4906825 0.81 CNR1 (0.35)
SCHEMBL4910948 0.80 ALDH1A1 (0.34) ALDH1A1
SCHEMBL4906811 0.79 CNR1 (0.37) LMNAALDH1A1
SCHEMBL4920299 0.79 KMT2A (0.33) PKMTP53MEN1KMT2A

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 PKM 2928/4885LMNA 3185/4885TP53 1980/4885

“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.