SCHEMBL1638596

SCHEMBL1638596

CN1CCN(C(=O)CC(=NNC(=O)c2ccccc2O)C(F)(F)F)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 11/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
MAPT P10636 9/20 0.44
KDM4E B2RXH2 7/20 0.44
KMT2A Q03164 5/20 0.44
MEN1 O00255 4/20 0.44
RECQL P46063 3/20 0.44
USP2 O75604 1/20 0.44
CASP6 P55212 1/20 0.44
THRB P10828 2/20 0.44
MPI P34949 1/20 0.44
LMNA P02545 3/20 0.43
HTT P42858 3/20 0.43
MAPK1 P28482 2/20 0.43
NPC1 O15118 3/20 0.42
RAB9A P51151 2/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
PKM P14618 1/20 0.42
HPGD P15428 3/20 0.40

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
SCHEMBL1638594 1.00 GAA (0.44) GAASMN1; SMN2MAPTKDM4EKMT2A
SCHEMBL1637566 0.87 NPC1 (0.50) GAASMN1; SMN2MAPTKDM4EKMT2A
SCHEMBL1637563 0.87 NPC1 (0.50) GAASMN1; SMN2MAPTKDM4EKMT2A
SCHEMBL1638809 0.85 KDM4E (0.56) GAASMN1; SMN2MAPTKDM4EKMT2A
SCHEMBL1638810 0.85 KDM4E (0.56) GAASMN1; SMN2MAPTKDM4EKMT2A
SCHEMBL1638328 0.77 GAA (0.51) GAASMN1; SMN2MAPTKDM4EKMT2A
SCHEMBL1638330 0.77 GAA (0.51) GAASMN1; SMN2MAPTKDM4EKMT2A
SCHEMBL13971505 0.77 NPC1 (0.44) GAASMN1; SMN2MAPTKDM4EKMT2A
SCHEMBL1639486 0.74 MAPT (0.49) GAASMN1; SMN2MAPTKDM4EKMT2A
SCHEMBL1638683 0.74 MAPT (0.49) GAASMN1; SMN2MAPTKDM4EKMT2A

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-20110098309-A1 METHODS OF INHIBITING THE FORMATION OF AMYLOID-BETA DIFFUSABLE LIGANDS USING ACYLHYDRAZIDE COMPOUNDS ACUMEN PHARMACEUTICALS, INC. (US) 2011-04-28 US claimed
US-20110098309-A1 METHODS OF INHIBITING THE FORMATION OF AMYLOID-BETA DIFFUSABLE LIGANDS USING ACYLHYDRAZIDE COMPOUNDS ACUMEN PHARMACEUTICALS, INC. (US) 2011-04-28 US disclosed
EP-2194975-A2 METHODS OF INHIBITING THE FORMATION OF AMYLOID-ß DIFFUSABLE LIGANDS USING A ACYLHYDRAZIDE COMPOUNDS Acumen Pharmaceuticals, Inc. (US) 2010-06-16 EP disclosed
WO-2009009768-A2 METHODS OF INHIBITING THE FORMATION OF AMYLOID-β DIFFUSABLE LIGANDS USING A ACYLHYDRAZIDE COMPOUDS ACUMEN PHARMACEUTICALS, INC. (US) 2009-01-15 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-20110098309-A1 METHODS OF INHIBITING THE FORMATION OF AMYLOID-BETA DIFFUSABLE LIGANDS USING ACYLHYDRAZIDE COMPOUNDS APP, APBA1, BACE1 GAA 166/4885SMN1; SMN2 486/4885MAPT 85/4885

“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.