SCHEMBL1638549

SCHEMBL1638549

O=C(CC(=NNC(=O)c1ccccc1O)C(F)(F)F)c1ccco1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.53
NPC1 O15118 4/20 0.53
RAB9A P51151 4/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
GAA P10253 5/20 0.51
MAPK1 P28482 2/20 0.51
MAPT P10636 7/20 0.49
LMNA P02545 4/20 0.49
HTT P42858 3/20 0.49
ALDH1A1 P00352 3/20 0.49
HPGD P15428 1/20 0.49
USP2 O75604 1/20 0.46
POLB P06746 1/20 0.46
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
ERCC5 P28715 1/20 0.42
FEN1 P39748 1/20 0.42
DUSP3 P51452 1/20 0.41
PTPN5 P54829 1/20 0.41
PTPN11 Q06124 1/20 0.41

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
SCHEMBL12726682 1.00 KDM4E (0.53) KDM4ENPC1RAB9ASMN1; SMN2GAA
SCHEMBL1638546 1.00 KDM4E (0.53) KDM4ENPC1RAB9ASMN1; SMN2GAA
SCHEMBL1638791 0.78 MAPT (0.78) KDM4ENPC1RAB9ASMN1; SMN2GAA
SCHEMBL1638795 0.78 MAPT (0.78) KDM4ENPC1RAB9ASMN1; SMN2GAA
SCHEMBL1638330 0.78 GAA (0.51) KDM4ENPC1RAB9ASMN1; SMN2GAA
SCHEMBL1638328 0.78 GAA (0.51) KDM4ENPC1RAB9ASMN1; SMN2GAA
SCHEMBL1637236 0.77 MAPT (0.54) KDM4ENPC1RAB9ASMN1; SMN2GAA
SCHEMBL1637237 0.77 MAPT (0.54) KDM4ENPC1RAB9ASMN1; SMN2GAA
SCHEMBL1638683 0.77 MAPT (0.49) KDM4ENPC1RAB9ASMN1; SMN2GAA
SCHEMBL1639486 0.77 MAPT (0.49) KDM4ENPC1RAB9ASMN1; SMN2GAA

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 3 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 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 KDM4E 4638/4885NPC1 732/4885RAB9A 2696/4885

“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.