SCHEMBL13551428

SCHEMBL13551428

COCCOCCn1c2ccccc2c2cc(/C=C/c3cc[n+](C)cc3)ccc21

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 3/20 0.72
▸ PTGER4 P35408 1/20 0.59
▸ KDM4E B2RXH2 1/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ PKM P14618 1/20 0.48
▸ NFKB1 P19838 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ NFKB2 Q00653 1/20 0.48
▸ RELA Q04206 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ ACHE P22303 3/20 0.45
▸ BCHE P06276 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.44
▸ GRIN1 Q05586 7/20 0.43
▸ GRIN2A Q12879 7/20 0.43
▸ GRIN2B Q13224 7/20 0.43
▸ MAOA P21397 5/20 0.43

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
SCHEMBL13551443 0.89 APP (0.65) APPPTGER4KDM4ENPC1ALDH1A1
SCHEMBL13551425 0.89 APP (0.71) APPPTGER4KDM4ENPC1ALDH1A1
Hydrochloric Acid SCHEMBL27894975 0.88 APP (0.62) APPPTGER4KDM4ENPC1ALDH1A1
Hydrochloric Acid SCHEMBL13387382 0.88 APP (0.73) APPPTGER4KDM4ENPC1ALDH1A1
Hydrochloric Acid SCHEMBL13387384 0.88 APP (0.73) APPPTGER4KDM4ENPC1ALDH1A1
SCHEMBL13551414 0.85 APP (0.98) APPPTGER4KDM4ENPC1ALDH1A1
Iodide SCHEMBL13387784 0.84 APP (0.75) APPPTGER4KDM4ENPC1ALDH1A1
Iodide SCHEMBL13387783 0.84 APP (0.75) APPPTGER4KDM4ENPC1ALDH1A1
Iodide SCHEMBL13387358 0.84 APP (1.00) APPPTGER4KDM4ENPC1ALDH1A1
Iodide SCHEMBL13387357 0.84 APP (1.00) APPPTGER4KDM4ENPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9795694-B2 Imaging beta-amyloid peptides aggregation HONG KONG BAPTIST UNIVERSITY (HK) 2017-10-24 — — US disclosed
US-20160243264-A1 Imaging Beta-Amyloid Peptides Aggregation HONG KONG BAPTIST UNIVERSITY (HK) 2016-08-25 — — US disclosed
US-9403794-B2 Imaging beta-amyloid peptides and inhibition of beta-amyloid peptide aggregation HONG KONG BAPTIST UNIVERSITY (HK) 2016-08-02 — — US disclosed
US-9255933-B2 Imaging beta-amyloid peptides and inhibition of beta-amyloid peptide aggregation HONG KONG BAPTIST UNIVERSITY (HK) 2016-02-09 — — US disclosed
US-9156814-B2 Imaging beta-amyloid peptides and inhibition of beta-amyloid peptide aggregation HONG KONG BAPTIST UNIVERSITY (HK) 2015-10-13 — — US disclosed
US-20140213614-A1 Imaging Beta-Amyloid Peptides and Inhibition of Beta-Amyloid Peptide Aggregation HONG KONG BAPTIST UNIVERSITY (HK) 2014-07-31 — — US disclosed
US-20140212360-A1 Imaging Beta-Amyloid Peptides and Inhibition of Beta-Amyloid Peptide Aggregation HONG KONG BAPTIST UNIVERSITY (HK) 2014-07-31 — — US disclosed
US-20120269738-A1 Imaging Beta-Amyloid Peptides and Inhibition of Beta-Amyloid Peptide Aggregation HONG KONG BAPTIST UNIVERSITY (HK) 2012-10-25 — — 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 (3 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-20120269738-A1 Imaging Beta-Amyloid Peptides and Inhibition of Beta-Amyloid Peptide Aggregation APP, IAPP, BACE1 APP 1/4885PTGER4 4506/4885KDM4E 4808/4885
US-20140213614-A1 Imaging Beta-Amyloid Peptides and Inhibition of Beta-Amyloid Peptide Aggregation APP, IAPP, BACE1 APP 1/4885PTGER4 4252/4885KDM4E 4811/4885
US-20160243264-A1 Imaging Beta-Amyloid Peptides Aggregation APP, IAPP, APBA1 APP 1/4885PTGER4 4526/4885KDM4E 4078/4885

“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.

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