SCHEMBL13403262

SCHEMBL13403262

COc1ccc(C[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.46
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
CRHBP P24387 3/20 0.46
CRHR2 Q13324 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
HPGD P15428 1/20 0.44
TAS2R14 Q9NYV8 1/20 0.41
FFAR4 Q5NUL3 1/20 0.40
DBH P09172 1/20 0.40
MAPT P10636 2/20 0.39
TTR P02766 1/20 0.39
CACNA1G O43497 1/20 0.39
CACNA1H O95180 1/20 0.39
CACNA1I Q9P0X4 1/20 0.39
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 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
Hydrochloric Acid SCHEMBL5524158 0.98 KDM1A (0.45) KDM1AMAOAMAOBCRHBPCRHR2
SCHEMBL16541886 0.87 CA2 (0.53) SMN1; SMN2HPGDMAPTTTRALDH1A1
Bromide SCHEMBL16180801 0.85 CA2 (0.52) KDM1AMAOAMAOBSMN1; SMN2HPGD
SCHEMBL12593861 0.83 MAPT (0.35) KDM1AMAOAMAOBCRHBPCRHR2
SCHEMBL2145470 0.83 GAA (0.57) MAPTTTRALDH1A1MEN1KMT2A
SCHEMBL9088704 0.83 GAA (0.54) MEN1KMT2AKDM4EGAA
SCHEMBL27776416 0.81 CYP1A2 (0.40) SMN1; SMN2FFAR4MAPTMEN1KMT2A
SCHEMBL14114732 0.79 S1PR1 (0.39)
SCHEMBL2144453 0.78 MEN1 (0.52) SMN1; SMN2HPGDMAPTALDH1A1MEN1
SCHEMBL1414593 0.77 PTGS2 (0.48) KDM1ASMN1; SMN2HPGDMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7700602-B2 Amino-5,5-diphenylimidazolone derivatives for the inhibition of β-secretase WYETH LLC (US) 2010-04-20 US disclosed
US-20090093498-A1 AMINO-5,5-DIPHENYLIMIDAZOLONE DERIVATIVES FOR THE INHIBITION OF BETA-SECRETASE WYETH (US) 2009-04-09 US disclosed
US-7482349-B2 Amino-5,5-diphenylimidazolone derivatives for the inhibition of β-secretase WYETH (US) 2009-01-27 US disclosed
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 (2 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 KDM1A 1537/4885MAOA 1622/4885MAOB 855/4885
US-20090093498-A1 AMINO-5,5-DIPHENYLIMIDAZOLONE DERIVATIVES FOR THE INHIBITION OF BETA-SECRETASE BACE1, BACE2, APP KDM1A 3158/4885MAOA 1319/4885MAOB 1233/4885

“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.