SCHEMBL505691

SCHEMBL505691

NC(=O)CN1CCN(CC(N)=O)C1c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43
CYP2C19 P33261 1/20 0.42
TACR1 P25103 3/20 0.42
KDM1A O60341 1/20 0.41
RECQL P46063 1/20 0.41
TP53 P04637 1/20 0.40
MDM2 Q00987 1/20 0.40
P2RX7 Q99572 1/20 0.39
RIPK1 Q13546 3/20 0.39
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
KCNN4 O15554 1/20 0.37

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
SCHEMBL505689 0.88 SIGMAR1 (0.39) POLBSIGMAR1KMT2AMEN1TSHR
SCHEMBL4461053 0.78 TACR1 (0.50) SIGMAR1KMT2AMEN1TACR1RIPK1
SCHEMBL7493746 0.77 KDM4E (0.55) SIGMAR1KMT2AMEN1TACR1RIPK1
SCHEMBL1109657 0.74 SIGMAR1 (0.41) SIGMAR1TSHRTACR1RIPK1ALDH1A1
Hydrochloric Acid SCHEMBL7293029 0.73 SIGMAR1 (0.40) SIGMAR1TACR1
SCHEMBL4178029 0.72 SLC18A3 (0.58) SIGMAR1KMT2AMEN1ALDH1A1GAA
SCHEMBL506196 0.72 RECQL (0.45) POLBSIGMAR1RECQLTP53MDM2
SCHEMBL24652524 0.71 ALDH1A1 (0.57) POLBSIGMAR1KMT2ATSHRTP53
SCHEMBL3165125 0.71 ALDH1A1 (0.57) POLBSIGMAR1KMT2ATSHRTP53
SCHEMBL15461422 0.71 PRCP (0.50) POLBKMT2AMEN1TSHRHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120029203-A1 Synthesis Of Triethylenetetramines PHILERA NEW ZEALAND LIMITED (NZ) 2012-02-02 US claimed
EP-1778618-A4 SYNTHESIS OF TRIETHYLENETETRAMINES PROTEMIX CORP LTD (NZ) 2008-07-16 EP claimed
EP-1778618-A2 SYNTHESIS OF TRIETHYLENETETRAMINES Protemix Corporation Limited (NZ) 2007-05-02 EP claimed
WO-2006027705-A2 SYNTHESIS OF TRIETHYLENETETRAMINES PROTEMIX CORPORATION LIMITED (NZ) 2006-03-16 WO claimed
US-20060041170-A1 starting the reaction of alkylating ethylenediamine with formaldehyde to form pure triethylenetetramine; salt formation of triethylenetetramine disuccinate or triethylenetetramine tetrahydrochloride PHILERA NEW ZEALAND LIMITED (NZ) 2006-02-23 US claimed
US-11795150-B2 Synthesis of triethylenetetramines PHILERA NEW ZEALAND LIMITED (NZ) 2023-10-24 US disclosed
US-11795150-B2 Synthesis of triethylenetetramines PHILERA NEW ZEALAND LIMITED (NZ) 2023-10-24 US disclosed
US-11795150-B2 Synthesis of triethylenetetramines PHILERA NEW ZEALAND LIMITED (NZ) 2023-10-24 US disclosed
US-20200148647-A1 Synthesis of Triethylenetetramines PHILERA NEW ZEALAND LIMITED (NZ) 2020-05-14 US disclosed
US-20200148647-A1 Synthesis of Triethylenetetramines PHILERA NEW ZEALAND LIMITED (NZ) 2020-05-14 US disclosed
US-20170226064-A1 Synthesis of Triethylenetetramines PHILERA NEW ZEALAND LIMITED (NZ) 2017-08-10 US disclosed
US-20170226064-A1 Synthesis of Triethylenetetramines PHILERA NEW ZEALAND LIMITED (NZ) 2017-08-10 US disclosed
US-20100173994-A1 Synthesis of triethylenetetramines PROTEMIX CORPORATION LIMITED (NZ) 2010-07-08 US disclosed
US-7582796-B2 starting the reaction of alkylating ethylenediamine with formaldehyde to form pure triethylenetetramine; salt formation of triethylenetetramine disuccinate or triethylenetetramine tetrahydrochloride PROTEMIX CORPORATION LIMITED (NZ) 2009-09-01 US disclosed
US-7582796-B2 starting the reaction of alkylating ethylenediamine with formaldehyde to form pure triethylenetetramine; salt formation of triethylenetetramine disuccinate or triethylenetetramine tetrahydrochloride PROTEMIX CORPORATION LIMITED (NZ) 2009-09-01 US disclosed
US-7582796-B2 starting the reaction of alkylating ethylenediamine with formaldehyde to form pure triethylenetetramine; salt formation of triethylenetetramine disuccinate or triethylenetetramine tetrahydrochloride PROTEMIX CORPORATION LIMITED (NZ) 2009-09-01 US disclosed
EP-1778618-A4 SYNTHESIS OF TRIETHYLENETETRAMINES PROTEMIX CORP LTD (NZ) 2008-07-16 EP disclosed
EP-1778618-A2 SYNTHESIS OF TRIETHYLENETETRAMINES Protemix Corporation Limited (NZ) 2007-05-02 EP disclosed
WO-2006027705-A2 SYNTHESIS OF TRIETHYLENETETRAMINES PROTEMIX CORPORATION LIMITED (NZ) 2006-03-16 WO disclosed
US-20060041170-A1 starting the reaction of alkylating ethylenediamine with formaldehyde to form pure triethylenetetramine; salt formation of triethylenetetramine disuccinate or triethylenetetramine tetrahydrochloride PHILERA NEW ZEALAND LIMITED (NZ) 2006-02-23 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 (6 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-11795150-B2 Synthesis of triethylenetetramines PNMT, TES, TPR POLB 1118/4885SIGMAR1 1752/4885KMT2A 120/4885
US-20170226064-A1 Synthesis of Triethylenetetramines PNMT, TES, TPR POLB 1118/4885SIGMAR1 1752/4885KMT2A 120/4885
US-20120029203-A1 Synthesis Of Triethylenetetramines PNMT, TES, TPR POLB 1118/4885SIGMAR1 1752/4885KMT2A 120/4885
US-20200148647-A1 Synthesis of Triethylenetetramines PNMT, TES, TPR POLB 1118/4885SIGMAR1 1752/4885KMT2A 120/4885
US-20060041170-A1 starting the reaction of alkylating ethylenediamine with formaldehyde to form pure triethylenetetramine; salt formation of triethylenetetramine disuccinate or triethylenetetramine tetrahydrochloride TET1, TET2, TET3 POLB 334/4885SIGMAR1 3134/4885KMT2A 107/4885
US-20100173994-A1 Synthesis of triethylenetetramines PNMT, TES, TPR POLB 1118/4885SIGMAR1 1752/4885KMT2A 120/4885

“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.