SCHEMBL516011

SCHEMBL516011

O=C1CCC2(CCCCCC2)CCN1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OR51E2 Q9H255 1/20 0.46
CRBN Q96SW2 6/20 0.44
FKBP5 Q13451 1/20 0.44
KDM4E B2RXH2 2/20 0.36
GAA P10253 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL13459880 1.00 OR51E2 (0.46) OR51E2CRBNFKBP5KDM4EGAA
SCHEMBL6920965 0.89 CRBN (0.48) OR51E2CRBNFKBP5KDM4EGAA
SCHEMBL16600340 0.84 CRBN (0.43) OR51E2CRBNFKBP5
SCHEMBL9986841 0.81 OR51E2 (0.34) OR51E2CRBNFKBP5GAA
SCHEMBL20633689 0.80 OR51E2 (0.37) OR51E2CRBNFKBP5GAA
SCHEMBL9210113 0.80 CRBN (0.38) OR51E2CRBNFKBP5
SCHEMBL6560160 0.77 OR51E2 (0.39) OR51E2CRBNFKBP5GAA
SCHEMBL20417911 0.76 NEK2 (0.41) OR51E2CRBNFKBP5KDM4EGAA
SCHEMBL24242233 0.71 CRBN (0.47) OR51E2CRBNFKBP5KDM4EGAA
SCHEMBL11821175 0.71 NPC1 (0.39) OR51E2CRBNFKBP5POLB

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 OR51E2 2094/4885CRBN 4372/4885FKBP5 2666/4885
US-20140024635-A1 INHIBITORS OF THE INFLUENZA A VIRUS M2 PROTON CHANNEL HVCN1, ATP6AP1, ASIC1 OR51E2 2094/4885CRBN 4372/4885FKBP5 2666/4885

“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.