SCHEMBL349850

SCHEMBL349850

O=C(O)[C@@H](CS)NCCB(O)O

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GGT1 P19440 9/20 0.53
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44
THRB P10828 1/20 0.44
ALOX15 P16050 1/20 0.44
NFKB1 P19838 1/20 0.44
PTGS2 P35354 1/20 0.44
THPO P40225 1/20 0.44
RECQL P46063 1/20 0.44
BLM P54132 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ACE P12821 1/20 0.40
FOLH1 Q04609 1/20 0.38
ARG2 P78540 5/20 0.33
ARG1 P05089 4/20 0.33
PTGS1 P23219 1/20 0.32
SLC7A11 Q9UPY5 1/20 0.32

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
SCHEMBL349849 1.00 GGT1 (0.53) GGT1KDM4EMAPTTHRBALOX15
SCHEMBL17378062 0.83 KDM4E (0.54) GGT1KDM4EMAPTTHRBALOX15
SCHEMBL900182 0.83 KDM4E (0.54) GGT1KDM4EMAPTTHRBALOX15
SCHEMBL900178 0.83 KDM4E (0.54) GGT1KDM4EMAPTTHRBALOX15
Hydrochloric Acid SCHEMBL16993797 0.81 KDM4E (0.52) GGT1KDM4EMAPTTHRBALOX15
SCHEMBL7259702 0.79 KDM4E (0.50) GGT1KDM4EMAPTTHRBALOX15
Ethylene SCHEMBL28132201 0.79 KDM4E (0.50) GGT1KDM4EMAPTTHRBALOX15
SCHEMBL313273 0.77 MAPT (0.48) GGT1KDM4EMAPTTHRBALOX15
SCHEMBL3137754 0.77 MAPT (0.48) GGT1KDM4EMAPTTHRBALOX15
SCHEMBL1157604 0.77 MAPT (0.48) GGT1KDM4EMAPTTHRBALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11779634-B2 Fungal iron acquisition inhibitors and uses thereof CASE WESTERN RESERVE UNIVERSITY (US) 2023-10-10 US claimed
US-20220211820-A1 FUNGAL IRON ACQUISITION INHIBITORS AND USES THEREOF UNIV CASE WESTERN RESERVE (US) 2022-07-07 US claimed
US-11229685-B2 Fungal iron acquisition inhibitors and uses thereof CASE WESTERN RESERVE UNIVERSITY (US) 2022-01-25 US claimed
US-20150366948-A1 FUNGAL IRON ACQUISITION INHIBITORS AND USES THEREOF CASE WESTERN RESERVE UNIVERSITY 2015-12-24 US claimed
US-8829004-B2 Method for inducing tumor apoptosis by increasing nitric oxide levels UNIVERSITAETSKLINIKUM FREIBURG (DE) 2014-09-09 US claimed
WO-2014120774-A1 FUNGAL IRON ACQUISITION INHIBITORS AND USES THEREOF CASE WESTERN RESERVE UNIVERSITY (US) 2014-08-07 WO claimed
EP-2056827-B1 METHOD FOR INDUCING TUMOR APOPTOSIS BY INCREASING NITRIC OXIDE LEVELS UNIVERSITAETSKLINIKUM FREIBURG (DE) 2013-12-25 EP claimed
US-20130059861-A1 METHOD FOR INDUCING TUMOR APOPTOSIS BY INCREASING NITRIC OXIDE LEVELS Universitätsklinikum Freiburg (DE) 2013-03-07 US claimed
US-20090264398-A1 METHOD FOR INDUCING TUMOR APOPTOSIS BY INCREASING NITRIC OXIDE LEVELS UNIVERSITATSKLINIKUM FREIBURG (DE) 2009-10-22 US claimed
EP-2056827-A1 METHOD FOR INDUCING TUMOR APOPTOSIS BY INCREASING NITRIC OXIDE LEVELS Universitätsklinikum Freiburg (DE) 2009-05-13 EP claimed
WO-2008071242-A1 METHOD FOR INDUCING TUMOR APOPTOSIS BY INCREASING NITRIC OXIDE LEVELS Universitätsklinikum Freiburg (DE) 2008-06-19 WO claimed
EP-1895012-A1 Method for inducing tumor apoptosis by increasing nitric oxide levels Universitätsklinikum Freiburg (DE) 2008-03-05 EP claimed
EP-4087583-B1 ARGINASE INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2026-04-22 EP disclosed
EP-3810615-B1 ARGINASE INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2026-01-28 EP disclosed
EP-3897622-B1 ARGINASE INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2026-01-14 EP disclosed
US-12240867-B2 Arginase inhibitors and methods of use MERCK SHARP & DOHME LLC (US) 2025-03-04 US disclosed
US-20080021097-A1 Arginase levels/activity REGENTS OF THE UNIVERSITY OF CALIFORNIA, THE 2008-01-24 US disclosed
WO-2007120709-A2 METHODS AND COMPOSITIONS FOR TREATMENT OF LESIONED SITES OF BODY VESSELS ABBOTT CARDIOVASCULAR SYSTEMS INC. (US) 2007-10-25 WO disclosed
US-20070243224-A1 Methods and compositions for treatment of lesioned sites of body vessels ADVANCED CARDIOVASCULAR SYSTEMS, INC. 2007-10-18 US disclosed
WO-2007111626-A2 ARGINASE II: A TARGET FOR THE PREVENTION AND TREATMENT OF ATHEROSCLEROSIS THE JOHNS HOPKINS UNIVERSITY (US) 2007-10-04 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 (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-11229685-B2 Fungal iron acquisition inhibitors and uses thereof SLC40A1, SLC30A6, SLC30A7 GGT1 1135/4885KDM4E 2245/4885MAPT 1759/4885
US-12240867-B2 Arginase inhibitors and methods of use ARG1, ARG2, PRMT1 GGT1 339/4885KDM4E 3207/4885MAPT 4174/4885
US-20220211820-A1 FUNGAL IRON ACQUISITION INHIBITORS AND USES THEREOF SLC40A1, SLC30A6, SLC30A7 GGT1 1135/4885KDM4E 2245/4885MAPT 1759/4885
US-20080021097-A1 Arginase levels/activity ARG1, ARG2, MPO GGT1 318/4885KDM4E 1893/4885MAPT 3564/4885
US-11779634-B2 Fungal iron acquisition inhibitors and uses thereof SLC40A1, SLC30A6, SLC30A7 GGT1 1135/4885KDM4E 2245/4885MAPT 1759/4885
US-20150366948-A1 FUNGAL IRON ACQUISITION INHIBITORS AND USES THEREOF SLC40A1, SLC30A6, SLC30A7 GGT1 1135/4885KDM4E 2245/4885MAPT 1759/4885

“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.