SCHEMBL1842941

SCHEMBL1842941

O=C(c1ccccc1)N1CCN(c2ccc([N+](=O)[O-])c(Nc3ccccc3)c2)CC1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 14/20 0.66
MAPT P10636 14/20 0.66
LMNA P02545 3/20 0.65
MAPK1 P28482 1/20 0.65
NPSR1 Q6W5P4 6/20 0.63
DCTPP1 Q9H773 4/20 0.59
KMT2A Q03164 3/20 0.55
MEN1 O00255 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
RECQL P46063 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
CYP3A4 P08684 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
HTT P42858 2/20 0.52
GAA P10253 1/20 0.52
KDM4E B2RXH2 1/20 0.52

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
SCHEMBL2389697 0.88 MAPT (0.66) ALDH1A1MAPTLMNAMAPK1NPSR1
SCHEMBL16752999 0.88 MAPT (0.59) ALDH1A1MAPTLMNAMAPK1NPSR1
SCHEMBL7937307 0.87 ALDH1A1 (0.65) ALDH1A1MAPTLMNAMAPK1NPSR1
SCHEMBL1846909 0.86 DCTPP1 (0.74) ALDH1A1MAPTLMNAMAPK1NPSR1
SCHEMBL1840936 0.86 ALDH1A1 (0.64) ALDH1A1MAPTLMNAMAPK1NPSR1
SCHEMBL12497325 0.85 MAPT (0.67) ALDH1A1MAPTLMNAMAPK1NPSR1
SCHEMBL1846449 0.85 DCTPP1 (0.81) ALDH1A1MAPTLMNAMAPK1NPSR1
SCHEMBL1843709 0.85 MAPT (0.57) ALDH1A1MAPTLMNAMAPK1NPSR1
SCHEMBL1843205 0.84 MAPT (0.82) ALDH1A1MAPTLMNAMAPK1NPSR1
SCHEMBL12497103 0.84 DCTPP1 (0.69) ALDH1A1MAPTLMNAMAPK1NPSR1

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2320897-A1 COMPOSITIONS AND METHODS OF TREATING AMYLOID DISEASE Treventis Corporation (US) 2011-05-18 EP claimed
WO-2010025375-A1 COMPOSITIONS AND METHODS OF TREATING AMYLOID DISEASE TREVENTIS CORPORATION (US) 2010-03-04 WO claimed
US-11568956-B2 Methods for identifying inhibitors of amyloid protein aggregation TREVENTIS CORPORATION (US) 2023-01-31 US disclosed
US-11568956-B2 Methods for identifying inhibitors of amyloid protein aggregation TREVENTIS CORPORATION (US) 2023-01-31 US disclosed
EP-3110812-B1 ANTI-AMYLOID COMPOUNDS CONTAINING BENZOFURAZAN TREVENTIS CORP (US) 2019-04-10 EP disclosed
US-20190050526-A1 METHODS FOR IDENTIFYING INHIBITORS OF AMYLOID PROTEIN AGGREGATION TREVENTIS CORPORATION (US) 2019-02-14 US disclosed
US-20190050526-A1 METHODS FOR IDENTIFYING INHIBITORS OF AMYLOID PROTEIN AGGREGATION TREVENTIS CORPORATION (US) 2019-02-14 US disclosed
US-9938249-B2 Anti-amyloid compounds containing benzofurazan TREVENTIS CORPORATION (US) 2018-04-10 US disclosed
US-9938249-B2 Anti-amyloid compounds containing benzofurazan TREVENTIS CORPORATION (US) 2018-04-10 US disclosed
US-20170174641-A1 ANTI-AMYLOID COMPOUNDS CONTAINING BENZOFURAZAN TREVENTIS CORPORATION (US) 2017-06-22 US disclosed
US-20170174641-A1 ANTI-AMYLOID COMPOUNDS CONTAINING BENZOFURAZAN TREVENTIS CORPORATION (US) 2017-06-22 US disclosed
EP-2320897-B1 COMPOSITIONS AND METHODS OF TREATING AMYLOID DISEASE TREVENTIS CORP (US) 2014-01-15 EP disclosed
US-8420640-B2 Methods of treating amyloid disease using analogs of 1-(4-nitrophenyl) piperazine TREVENTIS CORPORATION (US) 2013-04-16 US disclosed
US-8420640-B2 Methods of treating amyloid disease using analogs of 1-(4-nitrophenyl) piperazine TREVENTIS CORPORATION (US) 2013-04-16 US disclosed
US-8420640-B2 Methods of treating amyloid disease using analogs of 1-(4-nitrophenyl) piperazine TREVENTIS CORPORATION (US) 2013-04-16 US disclosed
US-20110218200-A1 METHODS OF TREATING AMYLOID DISEASE USING ANALOGS OF 1-(4-NITROPHENYL) PIPERAZINE TREVENTIS CORPORATION 2011-09-08 US disclosed
US-20110218200-A1 METHODS OF TREATING AMYLOID DISEASE USING ANALOGS OF 1-(4-NITROPHENYL) PIPERAZINE TREVENTIS CORPORATION 2011-09-08 US disclosed
EP-2320897-A1 COMPOSITIONS AND METHODS OF TREATING AMYLOID DISEASE Treventis Corporation (US) 2011-05-18 EP disclosed
WO-2010025375-A1 COMPOSITIONS AND METHODS OF TREATING AMYLOID DISEASE TREVENTIS CORPORATION (US) 2010-03-04 WO disclosed
WO-2010025375-A1 COMPOSITIONS AND METHODS OF TREATING AMYLOID DISEASE TREVENTIS CORPORATION (US) 2010-03-04 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 (2 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-20110218200-A1 METHODS OF TREATING AMYLOID DISEASE USING ANALOGS OF 1-(4-NITROPHENYL) PIPERAZINE PSEN1, PSEN2, APP ALDH1A1 1948/4885MAPT 10/4885LMNA 528/4885
US-20170174641-A1 ANTI-AMYLOID COMPOUNDS CONTAINING BENZOFURAZAN PRNP, PSEN1, APP ALDH1A1 1441/4885MAPT 14/4885LMNA 188/4885

“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.