SCHEMBL2823239

SCHEMBL2823239

C[C@@](CCCCN)(NO)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ODC1 P11926 2/20 0.37
NAALAD2 Q9Y3Q0 1/20 0.37
CYP2D6 P10635 1/20 0.37
NFKB1 P19838 1/20 0.37
BLM P54132 3/20 0.35
LMNA P02545 3/20 0.35
NPSR1 Q6W5P4 2/20 0.35
THRB P10828 2/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
PLG P00747 1/20 0.35
ALOX15 P16050 1/20 0.35
SLC6A2 P23975 1/20 0.35
RECQL P46063 1/20 0.35
SLC6A3 Q01959 1/20 0.35
PAOX Q6QHF9 3/20 0.35
FDPS P14324 2/20 0.35
ARG1 P05089 1/20 0.35
ARG2 P78540 1/20 0.35

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
SCHEMBL10659088 1.00 ODC1 (0.37) ODC1NAALAD2CYP2D6NFKB1BLM
SCHEMBL7924611 0.84 ODC1 (0.37) ODC1NAALAD2CYP2D6NFKB1BLM
SCHEMBL6567609 0.84 ODC1 (0.37) ODC1NAALAD2CYP2D6NFKB1BLM
SCHEMBL30410707 0.81 NAALAD2 (0.47) ODC1NAALAD2CYP2D6NFKB1BLM
SCHEMBL10912285 0.78 ODC1 (0.42) ODC1NAALAD2CYP2D6NFKB1BLM
SCHEMBL27905222 0.76 ODC1 (0.46) ODC1NAALAD2CYP2D6NFKB1BLM
Hydrochloric Acid SCHEMBL2543241 0.75 NAALAD2 (0.39) ODC1NAALAD2CYP2D6NFKB1BLM
SCHEMBL28937251 0.75 NAALAD2 (0.39) NAALAD2KMT2AMEN1TDP1
SCHEMBL7963542 0.75 NAALAD2 (0.39) NAALAD2KMT2AMEN1TDP1
SCHEMBL625789 0.74 FDPS (0.33) ODC1NAALAD2FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200188476-A1 ANTI-MICROBIAL AGENT-POLYMER CONJUGATES AND METHODS OF USE THEREOF UNIV CALIFORNIA (US) 2020-06-18 US disclosed
WO-2018195078-A1 ANTI-MICROBIAL AGENT-POLYMER CONJUGATES AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-10-25 WO disclosed
EP-3263586-A1 SHORT FATTY ACID TAIL POLYMYXIN DERIVATIVES AND USES THEREOF Northern Antibiotics Oy (FI) 2018-01-03 EP disclosed
EP-3078672-A1 POLYMYXIN DERIVATIVES AND USES THEREOF Northern Antibiotics Oy (FI) 2016-10-12 EP disclosed
EP-2057185-B1 POLYMYXIN DERIVATIVES AND USES THEREOF NORTHERN ANTIBIOTICS OY (FI) 2016-05-11 EP disclosed
US-9096649-B2 Polymyxin derivatives and uses thereof NORTHERN ANTIBIOTICS LTD. (FI) 2015-08-04 US disclosed
US-9090669-B2 Short fatty acid tail polymyxin derivatives and uses thereof NORTHERN ANTIBIOTICS LTD. (FI) 2015-07-28 US disclosed
US-9067974-B2 Polymyxin derivatives and uses thereof NORTHERN ANTIBIOTICS OY (FI) 2015-06-30 US disclosed
US-20140162937-A1 POLYMYXIN DERIVATIVES AND USES THEREOF NORTHERN ANTIBIOTICS LTD. (FI) 2014-06-12 US disclosed
US-20140142030-A1 SHORT FATTY ACID TAIL POLYMYXIN DERIVATIVES AND USES THEREOF NORTHERN ANTIBIOTICS LTD. (FI) 2014-05-22 US disclosed
US-7807637-B2 Polymyxin derivatives and uses thereof NORTHERN ANTIBIOTICS OY (FI) 2010-10-05 US disclosed
US-20090239792-A1 SHORT FATTY ACID TAIL POLYMYXIN DERIVATIVES AND USES THEREOF NORTHERN ANTIBIOTICS LTD. (FI) 2009-09-24 US disclosed
US-20090215677-A1 POLYMYXIN DERIVATIVES AND USES THEREOF NORTHERN ANTIBIOTICS LTD. (FI) 2009-08-27 US disclosed
WO-2009098357-A1 SHORT FATTY ACID TAIL POLYMYXIN DERIVATIVES AND USES THEREOF NORTHERN ANTIBIOTICS OY (FI) 2009-08-13 WO disclosed
EP-2057185-A1 POLYMYXIN DERIVATIVES AND USES THEREOF Northern Antibiotics Oy (FI) 2009-05-13 EP disclosed
US-20080287345-A1 Polymyxin derivatives and uses thereof NORTHERN ANTIBIOTICS OY (FI) 2008-11-20 US disclosed
WO-2008017734-A1 POLYMYXIN DERIVATIVES AND USES THEREOF NORTHERN ANTIBIOTICS OY (FI) 2008-02-14 WO disclosed
EP-0169300-B1 PROCESS FOR PREPARATION OF ALPHA-ALKYL AMINO ACIDS MERCK & CO. INC. (US) 1988-05-25 EP disclosed
EP-0169300-A1 Process for preparation of alpha-alkyl amino acids MERCK & CO. INC. (US) 1986-01-29 EP disclosed
US-4508921-A Process for preparation of alpha-alkyl amino acids MERCK & CO., INC. (US) 1985-04-02 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 (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-20090239792-A1 SHORT FATTY ACID TAIL POLYMYXIN DERIVATIVES AND USES THEREOF TLR5, TLR3, TLR2 ODC1 3795/4885NAALAD2 302/4885CYP2D6 3495/4885
US-20090215677-A1 POLYMYXIN DERIVATIVES AND USES THEREOF C5, C9, C3AR1 ODC1 708/4885NAALAD2 892/4885CYP2D6 2822/4885
US-20140162937-A1 POLYMYXIN DERIVATIVES AND USES THEREOF SLC11A2, TLR2, TLR5 ODC1 1543/4885NAALAD2 529/4885CYP2D6 1874/4885
US-20200188476-A1 ANTI-MICROBIAL AGENT-POLYMER CONJUGATES AND METHODS OF USE THEREOF DDOST, MGAM, MSN ODC1 3120/4885NAALAD2 285/4885CYP2D6 4142/4885
US-20140142030-A1 SHORT FATTY ACID TAIL POLYMYXIN DERIVATIVES AND USES THEREOF VIP, ELOVL5, TLR5 ODC1 4032/4885NAALAD2 460/4885CYP2D6 3551/4885
US-20080287345-A1 Polymyxin derivatives and uses thereof C9, C5, C3AR1 ODC1 674/4885NAALAD2 893/4885CYP2D6 2718/4885

“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.