SCHEMBL1638697

SCHEMBL1638697

C=CCc1cccc(C=NNC(=O)c2ccc(I)cc2)c1O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 11/20 0.64
MEN1 O00255 11/20 0.64
KMT2A Q03164 11/20 0.64
KDM4E B2RXH2 9/20 0.64
MAPT P10636 9/20 0.64
RAB9A P51151 3/20 0.64
NPC1 O15118 1/20 0.64
SMN1; SMN2 Q16637 8/20 0.64
LMNA P02545 7/20 0.58
ALOX12 P18054 1/20 0.58
MAPK1 P28482 1/20 0.54
ALDH1A1 P00352 1/20 0.53
TDP1 Q9NUW8 3/20 0.52
TP53 P04637 1/20 0.52
CASP3 P42574 1/20 0.52
RECQL P46063 1/20 0.52
CASP7 P55210 1/20 0.52
PKM P14618 1/20 0.52
MTOR P42345 1/20 0.52
NPSR1 Q6W5P4 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
SCHEMBL1638694 1.00 HTT (0.64) HTTMEN1KMT2AKDM4EMAPT
SCHEMBL684611 0.89 MEN1 (0.71) HTTMEN1KMT2AKDM4EMAPT
SCHEMBL12388017 0.81 KDM4E (0.74) HTTMEN1KMT2AKDM4EMAPT
SCHEMBL21082988 0.80 MEN1 (0.65) HTTMEN1KMT2AKDM4EMAPT
SCHEMBL17067838 0.80 MEN1 (0.65) HTTMEN1KMT2AKDM4EMAPT
SCHEMBL21082987 0.80 MEN1 (0.65) HTTMEN1KMT2AKDM4EMAPT
SCHEMBL10031205 0.79 KMT2A (0.73) HTTMEN1KMT2AKDM4EMAPT
SCHEMBL9458183 0.79 KMT2A (0.62) HTTMEN1KMT2AKDM4EMAPT
SCHEMBL9929304 0.78 MEN1 (0.63) HTTMEN1KMT2AKDM4EMAPT
SCHEMBL3717028 0.78 MEN1 (0.63) HTTMEN1KMT2AKDM4EMAPT

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-20110098309-A1 METHODS OF INHIBITING THE FORMATION OF AMYLOID-BETA DIFFUSABLE LIGANDS USING ACYLHYDRAZIDE COMPOUNDS ACUMEN PHARMACEUTICALS, INC. (US) 2011-04-28 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-20110098309-A1 METHODS OF INHIBITING THE FORMATION OF AMYLOID-BETA DIFFUSABLE LIGANDS USING ACYLHYDRAZIDE COMPOUNDS APP, APBA1, BACE1 HTT 11/4885MEN1 2974/4885KMT2A 3625/4885

“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.