SCHEMBL5060427

SCHEMBL5060427

CC(S)CC(Cc1cccnc1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 4/20 0.53
KDM4E B2RXH2 1/20 0.49
NAPRT Q6XQN6 1/20 0.47
LMNA P02545 1/20 0.47
FDPS P14324 1/20 0.47
ANPEP P15144 2/20 0.46
ERAP2 Q6P179 1/20 0.46
ERAP1 Q9NZ08 1/20 0.46
CYP1A2 P05177 1/20 0.45
PKM P14618 1/20 0.45
KMT2A Q03164 1/20 0.45
SLC1A3 P43003 1/20 0.44
SLC1A2 P43004 1/20 0.44
SLC1A1 P43005 1/20 0.44
CPA3 P15088 1/20 0.44
FOLH1 Q04609 1/20 0.44
CHRM1 P11229 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MMP9 P14780 1/20 0.43
MMP8 P22894 1/20 0.43

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
SCHEMBL5051173 0.86 PKM (0.49) TBXAS1KDM4ENAPRTLMNAFDPS
SCHEMBL7384333 0.85 CYP1A2 (0.62) TBXAS1KDM4ENAPRTLMNAFDPS
SCHEMBL5054321 0.83 CYP1A2 (0.66) ANPEPCYP1A2SLC1A3SLC1A2SLC1A1
SCHEMBL2566762 0.82 PKM (0.60) TBXAS1KDM4ENAPRTLMNAFDPS
SCHEMBL30660224 0.82 PKM (0.60) TBXAS1KDM4ENAPRTLMNAFDPS
SCHEMBL13636036 0.81 SLC1A1 (0.69) TBXAS1KDM4ENAPRTFDPSANPEP
SCHEMBL2267364 0.81 SLC1A1 (0.69) TBXAS1KDM4ENAPRTFDPSANPEP
SCHEMBL20366127 0.79 CPA1 (0.67) TBXAS1KDM4ENAPRTLMNAFDPS
SCHEMBL266473 0.79 TBXAS1 (0.80) TBXAS1KDM4ENAPRTLMNAFDPS
SCHEMBL15947894 0.79 TBXAS1 (0.80) TBXAS1KDM4ENAPRTLMNAFDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6395718-B1 RHEUMATIC DISEASES; ANTIARTHRITIC AGENTS; CARDIOVASCULAR DISORDERS GUILFORD PHARMACEUTICALS INC. 2002-05-28 US claimed
US-20080311037-A1 Compounds which bind PSMA and uses thereof NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2008-12-18 US disclosed
WO-2006093991-A1 COMPOUNDS WHICH BIND PSMA AND USES THEREOF THE CLEVELAND CLINIC FOUNDATION (US) 2006-09-08 WO disclosed
EP-1093453-B1 NAALADASE INHIBITORS USEFUL AS PHARMACEUTICAL COMPOUNDS AND COMPOSITIONS GUILFORD PHARM INC (US) 2005-09-28 EP disclosed
EP-1571141-A2 Naaladase inhibitors useful as pharmaceutical compounds and compositions GUILFORD PHARMACEUTICALS INC. (US) 2005-09-07 EP disclosed
US-6806261-B2 CONTROL RELEASE TRANSFORMING GROWTH FACTOR; CENTRAL NERVOUS SYSTEM DISORDERS; ANTIPROLIFERATIVE AGENT GUILFORD PHARMACEUTICALS INC. 2004-10-19 US disclosed
EP-1202717-B1 USE OF NAALADASE INHIBITORS FOR TREATING ANXIETY AND MEMORY DISORDERS GUILFORD PHARM INC (US) 2004-03-03 EP disclosed
EP-1371367-A1 Use of naaladase inhibitors for the manufacture of a medicament for the treatment of certain diseases GUILFORD PHARMACEUTICALS INC. (US) 2003-12-17 EP disclosed
EP-1140048-B1 USE OF NAALADASE INHIBITORS FOR THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF CERTAIN DISEASES GUILFORD PHARM INC (US) 2003-09-03 EP disclosed
US-20030083374-A1 NAALADase inhibitors useful as pharmaceutical compounds and compositions JACKSON PAUL F (US) 2003-05-01 US disclosed
US-6395718-B1 RHEUMATIC DISEASES; ANTIARTHRITIC AGENTS; CARDIOVASCULAR DISORDERS GUILFORD PHARMACEUTICALS INC. 2002-05-28 US disclosed
EP-1202717-A2 NAALADASE INHIBITORS IN ANXIETY AND MEMORY DISORDERS GUILFORD PHARMACEUTICALS INC. (US) 2002-05-08 EP disclosed
US-6376478-B1 N-ACETYLATED (ALPHA)-LINKED ACIDIC DIPEPTIDASE INHIBITOR; BLOCKS RELEASE OF GLUTAMTE PRE-SYNAPTICALLY FOR REDUCED TOXICITY GUILFORD PHARMACEUTICALS INC. 2002-04-23 US disclosed
EP-1140048-A2 METHODS FOR TREATING CERTAIN DISEASES USING NAALADASE INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 2001-10-10 EP disclosed
US-6265609-B1 INHIBIT N-ACETYLATED .ALPHA.-LINKED ACIDIC DIPEPTIDASE (NAALADASE) ENZYME ACTIVITY; IN DRUGS TO TREAT GLUTAMATE ABNORMALITIES; COMPULSIVE DISORDERS AND PROSTATE DISEASES, TO EFFECT NEURONAL ACTIVITIES GUILFORD PHARMACEUTICALS INC. 2001-07-24 US disclosed
US-6228888-B1 Methods for treating anxiety, anxiety disorders and memory impairment using naaladase inhibitors GUILFORD PHARMACEUTICALS INC. 2001-05-08 US disclosed
EP-1093453-A1 NAALADASE INHIBITORS USEFUL AS PHARMACEUTICAL COMPOUNDS AND COMPOSITIONS GUILFORD PHARMACEUTICALS INC. (US) 2001-04-25 EP disclosed
WO-2001001974-A2 NAALADASE INHIBITORS IN ANXIETY AND MEMORY DISORDERS GUILFORD PHARMACEUTICALS INC. (US) 2001-01-11 WO disclosed
WO-2000038785-A2 METHODS FOR TREATING CERTAIN DISEASES USING NAALADASE INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 2000-07-06 WO disclosed
WO-2000001668-A2 NAALADASE INHIBITORS USEFUL AS PHARMACEUTICAL COMPOUNDS AND COMPOSITIONS GUILFORD PHARMACEUTICALS INC. (US) 2000-01-13 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 (2 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-20080311037-A1 Compounds which bind PSMA and uses thereof FOLH1, PSMA1, BPHL TBXAS1 1581/4885KDM4E 1768/4885NAPRT 2735/4885
US-20030083374-A1 NAALADase inhibitors useful as pharmaceutical compounds and compositions NAALAD2, DNPEP, NAAA TBXAS1 1580/4885KDM4E 2930/4885NAPRT 168/4885

“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.