SCHEMBL7054675

SCHEMBL7054675

CCCCSC(=S)NC(CCC(=O)O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 8/20 0.49
NAALAD2 Q9Y3Q0 2/20 0.49
RIMKLA Q8IXN7 1/20 0.49
NOD1 Q9Y239 3/20 0.46
HDAC2 Q92769 1/20 0.43
GAA P10253 1/20 0.43
GGH Q92820 1/20 0.40
PLA2G2C Q5R387 1/20 0.39

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
SCHEMBL7050234 0.91 FOLH1 (0.51) FOLH1NAALAD2RIMKLANOD1GAA
SCHEMBL7054071 0.84 FOLH1 (0.55) FOLH1NAALAD2RIMKLAGAAGGH
SCHEMBL5052955 0.78 FOLH1 (0.58) FOLH1NAALAD2RIMKLAGAAGGH
SCHEMBL29197477 0.76 NOD1 (0.59) FOLH1NAALAD2RIMKLANOD1PLA2G2C
SCHEMBL7053290 0.75 FOLH1 (0.49) FOLH1PLA2G2C
SCHEMBL23221739 0.74 FOLH1 (0.75) FOLH1NAALAD2RIMKLANOD1
SCHEMBL20694459 0.74 FOLH1 (0.75) FOLH1NAALAD2RIMKLANOD1
SCHEMBL15846438 0.74 NOD1 (0.71) FOLH1NAALAD2RIMKLANOD1PLA2G2C
SCHEMBL15846439 0.74 NOD1 (0.71) FOLH1NAALAD2RIMKLANOD1PLA2G2C
SCHEMBL11977636 0.73 FOLH1 (0.72) FOLH1NAALAD2RIMKLANOD1

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 4 patents. 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-20030064912-A1 Pharmaceutical compositions and methods of inhibiting angiogenesis using NAALADase inhibitors SLUSHER BARBARA S (US) 2003-04-03 US disclosed
US-6395718-B1 RHEUMATIC DISEASES; ANTIARTHRITIC AGENTS; CARDIOVASCULAR DISORDERS GUILFORD PHARMACEUTICALS INC. 2002-05-28 US 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20030064912-A1 Pharmaceutical compositions and methods of inhibiting angiogenesis using NAALADase inhibitors NAALAD2, DNPEP, DPP9 FOLH1 56/4885NAALAD2 1/4885RIMKLA 45/4885

“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.