SCHEMBL4159488

SCHEMBL4159488

COc1cccc(CN2CCCCC2)c1O

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.65
KMT2A Q03164 3/20 0.65
TSHR P16473 2/20 0.61
GAA P10253 2/20 0.56
ALDH1A1 P00352 2/20 0.55
HRH3 Q9Y5N1 1/20 0.53
KDM4E B2RXH2 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
MAPK1 P28482 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.50
IDO1 P14902 1/20 0.50
DRD2 P14416 1/20 0.50
DRD4 P21917 1/20 0.50
HRH2 P25021 1/20 0.50
HRH1 P35367 1/20 0.50
DRD3 P35462 1/20 0.50
GFER P55789 1/20 0.50

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
SCHEMBL4593177 0.92 KMT2A (0.69) MEN1KMT2ATSHRGAAALDH1A1
SCHEMBL12771578 0.85 MEN1 (0.59) MEN1KMT2ATSHRGAAALDH1A1
SCHEMBL15347253 0.85 KMT2A (0.62) MEN1KMT2ATSHRGAAALDH1A1
SCHEMBL4161324 0.85 CYP2C9 (0.61) MEN1KMT2ATSHRGAAALDH1A1
SCHEMBL14375363 0.84 KMT2A (0.57) MEN1KMT2ATSHRMAPK1
SCHEMBL3161038 0.83 MEN1 (0.82) MEN1KMT2ATSHRALDH1A1HRH3
SCHEMBL7643165 0.83 KDM4E (0.68) MEN1KMT2ATSHRALDH1A1KDM4E
SCHEMBL13284339 0.82 MEN1 (0.79) MEN1KMT2ATSHRALDH1A1HRH3
SCHEMBL30275949 0.81 KDM4E (0.56) TSHRALDH1A1HRH3KDM4EL3MBTL1
SCHEMBL12771595 0.81 MEN1 (0.51) MEN1KMT2ATSHRGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090118282-A1 Compounds and methods for treatment of amyloid-beta-peptide related disorders EXONHIT THERAPEUTICS SA (FR) 2009-05-07 US disclosed
US-20090118282-A1 Compounds and methods for treatment of amyloid-beta-peptide related disorders EXONHIT THERAPEUTICS SA (FR) 2009-05-07 US disclosed
US-20090118282-A1 Compounds and methods for treatment of amyloid-beta-peptide related disorders EXONHIT THERAPEUTICS SA (FR) 2009-05-07 US disclosed
EP-1910334-A2 COMPOUNDS AND METHODS FOR TREATMENT OF AMYLOID-BETA-PEPTIDE RELATED DISORDERS Exonhit Therapeutics SA (FR) 2008-04-16 EP disclosed
WO-2007034329-A2 COMPOUNDS AND METHODS FOR TREATMENT OF AMYLOID-BETA-PEPTIDE RELATED DISORDERS EXONHIT THERAPEUTICS SA (FR) 2007-03-29 WO disclosed
WO-2007034329-A2 COMPOUNDS AND METHODS FOR TREATMENT OF AMYLOID-BETA-PEPTIDE RELATED DISORDERS EXONHIT THERAPEUTICS SA (FR) 2007-03-29 WO 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-20090118282-A1 Compounds and methods for treatment of amyloid-beta-peptide related disorders APP, BACE1, IAPP MEN1 2503/4885KMT2A 4074/4885TSHR 3395/4885

“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.