SCHEMBL7270004

SCHEMBL7270004

CC(C)(C)OC(=O)NCCCCN(CCCCN)C(=O)OC(C)(C)C

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA14 Q9ULX7 1/20 0.58
TDP1 Q9NUW8 1/20 0.53
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
MEN1 O00255 1/20 0.47
GAA P10253 1/20 0.47
KMT2A Q03164 1/20 0.47
CA1 P00915 9/20 0.45
CA2 P00918 9/20 0.45
CA12 O43570 6/20 0.45
CA9 Q16790 6/20 0.45
PAOX Q6QHF9 2/20 0.40
STK17B O94768 1/20 0.38
STK17A Q9UEE5 1/20 0.38
KDM4A O75164 1/20 0.36
HIF1A Q16665 1/20 0.36
TET2 Q6N021 1/20 0.36
DOHH Q9BU89 1/20 0.36
EPHX1 P07099 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
SCHEMBL7264039 1.00 CA14 (0.58) CA14TDP1MAOAMAOBMEN1
SCHEMBL5919555 0.97 CA14 (0.58) CA14TDP1MAOAMAOBMEN1
SCHEMBL7631999 0.97 CA14 (0.62) CA14TDP1MAOAMAOBMEN1
SCHEMBL19340291 0.96 CA14 (0.57) CA14TDP1MAOAMAOBMEN1
SCHEMBL3472122 0.94 CA14 (0.62) CA14TDP1MAOAMAOBMEN1
SCHEMBL1919913 0.93 CA14 (0.60) CA14TDP1MAOAMAOBMEN1
SCHEMBL10181287 0.93 CA14 (0.53) CA14TDP1MAOAMAOBMEN1
SCHEMBL4370840 0.93 CA14 (0.59) CA14TDP1MAOAMAOBMEN1
SCHEMBL18258336 0.92 CA14 (0.53) CA14TDP1MAOAMAOBMEN1
SCHEMBL13055412 0.91 CA14 (0.64) CA14TDP1MAOAMAOBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9730902-B2 Polyamine transport inhibitors as novel therapeutics UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2017-08-15 US disclosed
US-9730902-B2 Polyamine transport inhibitors as novel therapeutics UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2017-08-15 US disclosed
US-9730902-B2 Polyamine transport inhibitors as novel therapeutics UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2017-08-15 US disclosed
US-9598351-B2 Polyamine transporter selective compounds as anti-cancer agents UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2017-03-21 US disclosed
US-20160151312-A1 POLYAMINE TRANSPORT INHIBITORS AS NOVEL THERAPEUTICS UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2016-06-02 US disclosed
US-20160151312-A1 POLYAMINE TRANSPORT INHIBITORS AS NOVEL THERAPEUTICS UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2016-06-02 US disclosed
US-9212131-B2 Polyamine transport inhibitors as novel therapeutics UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2015-12-15 US disclosed
US-9212131-B2 Polyamine transport inhibitors as novel therapeutics UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2015-12-15 US disclosed
US-9150495-B2 Polyamine transporter selective compounds as anti cancer agents UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2015-10-06 US disclosed
US-20140057989-A1 POLYAMINE TRANSPORTER SELECTIVE COMPOUNDS AS ANTI CANCER AGENTS UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2014-02-27 US disclosed
US-8497398-B1 Polyamine transporter selective compounds as anti-cancer agents UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2013-07-30 US disclosed
US-20120172449-A1 POLYAMINE TRANSPORT INHIBITORS AS NOVEL THERAPEUTICS UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. 2012-07-05 US disclosed
US-20120172449-A1 POLYAMINE TRANSPORT INHIBITORS AS NOVEL THERAPEUTICS UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. 2012-07-05 US disclosed
US-7910363-B1 Lipophilic polyamines providing enhanced intracellular delivery of agents by a polyamine transport system UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2011-03-22 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-20160151312-A1 POLYAMINE TRANSPORT INHIBITORS AS NOVEL THERAPEUTICS SLC19A1, SLC75A1, SLC46A1 CA14 4640/4885TDP1 1799/4885MAOA 521/4885
US-20120172449-A1 POLYAMINE TRANSPORT INHIBITORS AS NOVEL THERAPEUTICS SLC19A1, SLC75A1, SLC46A1 CA14 4640/4885TDP1 1799/4885MAOA 521/4885

“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.