SCHEMBL515788

SCHEMBL515788

O=C1C=CC2(CCCCCC2)CC1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
ALOX5 P09917 1/20 0.31

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
SCHEMBL9449773 1.00 ALDH1A1 (0.34) ALDH1A1ALOX5
SCHEMBL1373549 1.00 ALDH1A1 (0.34) ALDH1A1ALOX5
SCHEMBL516008 0.98 ALDH1A1 (0.36) ALDH1A1ALOX5
SCHEMBL13333805 0.93 ALDH1A1 (0.36) ALDH1A1ALOX5
SCHEMBL9140299 0.88
SCHEMBL2435959 0.79 POLB (0.32)
SCHEMBL17277743 0.78 NEK2 (0.31)
SCHEMBL3728133 0.78
SCHEMBL4409815 0.77 ALDH1A1 (0.34) ALDH1A1ALOX5
SCHEMBL11956609 0.76 ALOX5 (0.30) ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9403777-B2 Inhibitors of the influenza A virus M2 proton channel THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2016-08-02 US disclosed
US-9403777-B2 Inhibitors of the influenza A virus M2 proton channel THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2016-08-02 US disclosed
US-9403777-B2 Inhibitors of the influenza A virus M2 proton channel THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2016-08-02 US disclosed
US-20140024635-A1 INHIBITORS OF THE INFLUENZA A VIRUS M2 PROTON CHANNEL THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2014-01-23 US disclosed
US-20140024635-A1 INHIBITORS OF THE INFLUENZA A VIRUS M2 PROTON CHANNEL THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2014-01-23 US disclosed
US-20140024635-A1 INHIBITORS OF THE INFLUENZA A VIRUS M2 PROTON CHANNEL THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2014-01-23 US disclosed
US-8569284-B2 Inhibitors of the influenza A virus M2 proton channel THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2013-10-29 US disclosed
US-8569284-B2 Inhibitors of the influenza A virus M2 proton channel THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2013-10-29 US disclosed
US-8569284-B2 Inhibitors of the influenza A virus M2 proton channel THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2013-10-29 US disclosed
US-20120028957-A1 Inhibitors Of The Influenza A Virus M2 Proton Channel THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2012-02-02 US disclosed
US-20120028957-A1 Inhibitors Of The Influenza A Virus M2 Proton Channel THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2012-02-02 US disclosed
US-20120028957-A1 Inhibitors Of The Influenza A Virus M2 Proton Channel THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2012-02-02 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 (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-20120028957-A1 Inhibitors Of The Influenza A Virus M2 Proton Channel HVCN1, ATP6AP1, ASIC1 ALDH1A1 2559/4885ALOX5 4150/4885
US-20140024635-A1 INHIBITORS OF THE INFLUENZA A VIRUS M2 PROTON CHANNEL HVCN1, ATP6AP1, ASIC1 ALDH1A1 2559/4885ALOX5 4150/4885

“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.