SCHEMBL5595391

SCHEMBL5595391

CC(C)NCCP(=O)(O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 2/20 0.43
ALDH1A1 P00352 3/20 0.41
TDP1 Q9NUW8 1/20 0.41
TYMS P04818 1/20 0.39
S1PR2 O95136 5/20 0.38
S1PR4 O95977 5/20 0.38
S1PR1 P21453 5/20 0.38
S1PR3 Q99500 5/20 0.38
S1PR5 Q9H228 1/20 0.38
PGK1 P00558 1/20 0.36
PGK2 P07205 1/20 0.36
LPAR3 Q9UBY5 3/20 0.36
LPAR2 Q9HBW0 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP9 P14780 1/20 0.36
MMP8 P22894 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
Hydrochloric Acid SCHEMBL5985871 0.98 ANPEP (0.41) ANPEPALDH1A1TDP1TYMSS1PR2
SCHEMBL12269224 0.86 S1PR2 (0.48) ANPEPALDH1A1TDP1TYMSS1PR2
SCHEMBL14179660 0.84 S1PR2 (0.47) ANPEPALDH1A1TDP1TYMSS1PR2
SCHEMBL5985307 0.76 FDPS (0.45) ALDH1A1TDP1S1PR2S1PR4S1PR1
SCHEMBL5985301 0.76 FDPS (0.45) ALDH1A1TDP1S1PR2S1PR4S1PR1
SCHEMBL744518 0.75
SCHEMBL14179669 0.75 GABBR2 (0.46) ALDH1A1TDP1S1PR2S1PR4S1PR1
SCHEMBL14983985 0.74 PPARD (0.53) ALDH1A1TDP1CA12CA1CA2
SCHEMBL9195085 0.74
SCHEMBL12873247 0.73 ANPEP (0.57) ANPEPALDH1A1TDP1TYMSS1PR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1064254-B1 ALIPHATIC AMINO CARBOXYLIC AND AMINO PHOSPHONIC ACIDS, AMINO NITRILES AND AMINO TETRAZOLES AS CELLULAR RESCUE AGENTS UNIV SASKATCHEWAN (CA) 2007-10-17 EP claimed
US-20050159393-A1 Aliphatic amino carboxylic and amino phosphonic acids, amino nitriles and amino tetrazoles as cellular rescue agents UNIVERSITY OF SASKATCHEWAN TECHNOLOGIES INC. (CA) 2005-07-21 US claimed
JP-2002507591-A 2002-03-12 JP claimed
EP-1064254-A2 ALIPHATIC AMINO CARBOXYLIC AND AMINO PHOSPHONIC ACIDS, AMINO NITRILES AND AMINO TETRAZOLES AS CELLULAR RESCUE AGENTS University of Saskatchewan Technologies Inc. (CA) 2001-01-03 EP claimed
WO-1999048858-A2 ALIPHATIC AMINO CARBOXYLIC AND AMINO PHOSPHONIC ACIDS, AMINO NITRILES AND AMINO TETRAZOLES AS CELLULAR RESCUE AGENTS UNIVERSITY OF SASKATCHEWAN TECHNOLOGIES INC. (CA) 1999-09-30 WO claimed
US-12251873-B2 Three-dimensional printing HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2025-03-18 US disclosed
US-20240218011-A1 GLUCOCORTICOID RECEPTOR AGONISTS AND CONJUGATES THEREOF FIREFLY BIO, INC. 2024-07-04 US disclosed
EP-3765266-B1 THREE-DIMENSIONAL PRINTING HEWLETT PACKARD DEVELOPMENT CO (US) 2024-02-21 EP disclosed
US-11873291-B2 Quinoline cGAS antagonist compounds IMMUNESENSOR THERAPEUTICS, INC. (US) 2024-01-16 US disclosed
US-20210332080-A1 HYDROPHILIC LINKERS FOR ANTIBODY DRUG CONJUGATES REGENERON PHARMACEUTICALS, INC. 2021-10-28 US disclosed
US-20210213532-A1 THREE-DIMENSIONAL PRINTING HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2021-07-15 US disclosed
US-20210213532-A1 THREE-DIMENSIONAL PRINTING HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2021-07-15 US disclosed
US-20070270396-A1 Geldanamycin compounds and method of use KOSAN BIOSCIENCES INCORPORATED (US) 2007-11-22 US disclosed
US-20070270396-A1 Geldanamycin compounds and method of use KOSAN BIOSCIENCES INCORPORATED (US) 2007-11-22 US disclosed
EP-1064254-B1 ALIPHATIC AMINO CARBOXYLIC AND AMINO PHOSPHONIC ACIDS, AMINO NITRILES AND AMINO TETRAZOLES AS CELLULAR RESCUE AGENTS UNIV SASKATCHEWAN (CA) 2007-10-17 EP disclosed
US-7259156-B2 Geldanamycin compounds and method of use KOSAN BIOSCIENCES INCORPORATED (US) 2007-08-21 US disclosed
US-6984754-B1 Aliphatic amino carboxylic and amino phosphonic acids amino nitriles and amino tetrazoles as cellular rescue agents UNIVERSITY OF SASKATCHEWAN TECHNOLOGIES INC. (CA) 2006-01-10 US disclosed
US-20050159393-A1 Aliphatic amino carboxylic and amino phosphonic acids, amino nitriles and amino tetrazoles as cellular rescue agents UNIVERSITY OF SASKATCHEWAN TECHNOLOGIES INC. (CA) 2005-07-21 US disclosed
EP-1064254-A2 ALIPHATIC AMINO CARBOXYLIC AND AMINO PHOSPHONIC ACIDS, AMINO NITRILES AND AMINO TETRAZOLES AS CELLULAR RESCUE AGENTS University of Saskatchewan Technologies Inc. (CA) 2001-01-03 EP disclosed
WO-1999048858-A2 ALIPHATIC AMINO CARBOXYLIC AND AMINO PHOSPHONIC ACIDS, AMINO NITRILES AND AMINO TETRAZOLES AS CELLULAR RESCUE AGENTS UNIVERSITY OF SASKATCHEWAN TECHNOLOGIES INC. (CA) 1999-09-30 WO 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 (5 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-20210332080-A1 HYDROPHILIC LINKERS FOR ANTIBODY DRUG CONJUGATES CD44, CD47, EPCAM ANPEP 511/4885ALDH1A1 1502/4885TDP1 3694/4885
US-20240218011-A1 GLUCOCORTICOID RECEPTOR AGONISTS AND CONJUGATES THEREOF NR3C1, NR3C2, MC2R ANPEP 2915/4885ALDH1A1 3778/4885TDP1 3200/4885
US-11873291-B2 Quinoline cGAS antagonist compounds CGAS, GLS2, GLS ANPEP 1189/4885ALDH1A1 4236/4885TDP1 69/4885
US-20070270396-A1 Geldanamycin compounds and method of use HSP90AA1, HSP90AB1, HSP90B1 ANPEP 3027/4885ALDH1A1 529/4885TDP1 1136/4885
US-20050159393-A1 Aliphatic amino carboxylic and amino phosphonic acids, amino nitriles and amino tetrazoles as cellular rescue agents CHAMP1, PYCR1, PRMT5 ANPEP 191/4885ALDH1A1 4603/4885TDP1 2571/4885

“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.