SCHEMBL10033848

SCHEMBL10033848

NCCCC[C@@H](N)C(=O)NCCCNCCCCNCCCN

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.69
GNAO1 P09471 1/20 0.69
GNAI1 P63096 1/20 0.69
DPP7 Q9UHL4 2/20 0.57
RRM1 P23921 1/20 0.55
NOS1 P29475 1/20 0.49
MMP2 P08253 1/20 0.49
TERT O14746 4/20 0.48
GSR P00390 1/20 0.47
CA12 O43570 2/20 0.47
F13A1 P00488 2/20 0.47
CA2 P00918 2/20 0.47
CYP1A2 P05177 2/20 0.47
ALOX15 P16050 2/20 0.47
CA4 P22748 2/20 0.47
CA6 P23280 2/20 0.47
CA5A P35218 2/20 0.47
THPO P40225 2/20 0.47
CA7 P43166 2/20 0.47
CA9 Q16790 2/20 0.47

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
SCHEMBL24179776 1.00 GNAI3 (0.69) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL12085475 1.00 GNAI3 (0.69) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL5965247 0.98 GNAI3 (0.71) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL5965329 0.98 GNAI3 (0.71) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL7083787 0.98 GNAI3 (0.71) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL5965246 0.98 GNAI3 (0.71) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL5497912 0.97 GNAI3 (0.69) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL5965168 0.95 GNAI3 (0.67) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL5965319 0.95 GNAI3 (0.67) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL5965169 0.93 GNAI3 (0.64) GNAI3GNAO1GNAI1DPP7RRM1

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-20220096412-A1 Combination Drug Substance of Polyamine Transport Inhibitor and DFMO AMINEX THERAPEUTICS, INC. 2022-03-31 US disclosed
EP-3785706-A1 BIOAVAILABLE POLYAMINES Aminex Therapeutics, Inc. (US) 2021-03-03 EP disclosed
US-20200352983-A1 BIOAVAILABLE POLYAMINES AMINEX THERAPEUTICS INC. 2020-11-12 US disclosed
US-10632145-B2 Bioavailable polyamines AMINEX THERAPEUTICS, INC. (US) 2020-04-28 US disclosed
WO-2017165313-A1 BIOAVAILABLE POLYAMINES AMINEX THERAPEUTICS INC. (US) 2017-09-28 WO disclosed
US-20170273926-A1 COMPOSITIONS AND METHODS FOR USE OF EFLORNITHINE AND DERIVATIVES AND ANALOGS THEREOF TO TREAT CANCERS, INCLUDING GLIOMAS Orbus Therapeutics, Inc. 2017-09-28 US disclosed
EP-1373185-B1 HYDROPHOBIC POLYAMINE ANALOGS AND METHODS FOR THEIR USE AMINEX THERAPEUTICS INC (US) 2017-03-01 EP disclosed
US-RE43327-E1 Hydrophobic polyamine analogs and methods for their use AMINEX THERAPEUTICS, INC. (US) 2012-04-24 US disclosed
US-RE43327-E1 Hydrophobic polyamine analogs and methods for their use AMINEX THERAPEUTICS, INC. (US) 2012-04-24 US disclosed
US-7432302-B2 Composition containing polyamine transport inhibitor and use thereof MEDIQUEST THERAPEUTICS, INC. (US) 2008-10-07 US disclosed
US-7432302-B2 Composition containing polyamine transport inhibitor and use thereof MEDIQUEST THERAPEUTICS, INC. (US) 2008-10-07 US disclosed
US-7208528-B1 Polyamine analogues as therapeutic and diagnostic agents MEDIQUEST THERAPEUTICS, INC. (US) 2007-04-24 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 (4 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-20220096412-A1 Combination Drug Substance of Polyamine Transport Inhibitor and DFMO SLC7A1, SLC19A1, SLC35E1 GNAI3 3822/4885GNAO1 1156/4885GNAI1 3730/4885
US-20200352983-A1 BIOAVAILABLE POLYAMINES SLC7A1, SRM, SLC46A1 GNAI3 3121/4885GNAO1 3211/4885GNAI1 3122/4885
US-10632145-B2 Bioavailable polyamines SLC7A1, SRM, SLC46A1 GNAI3 3121/4885GNAO1 3211/4885GNAI1 3122/4885
US-20170273926-A1 COMPOSITIONS AND METHODS FOR USE OF EFLORNITHINE AND DERIVATIVES AND ANALOGS THEREOF TO TREAT CANCERS, INCLUDING GLIOMAS AHCY, SRM, SHMT1 GNAI3 1394/4885GNAO1 835/4885GNAI1 1455/4885

“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.