SCHEMBL7613147

SCHEMBL7613147

CC(S)CSCC(CCC(=O)O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 14/20 0.50
CYP1A2 P05177 1/20 0.44
GRM3 Q14832 2/20 0.42
NAALAD2 Q9Y3Q0 1/20 0.42

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
SCHEMBL5059822 0.77 FOLH1 (0.57) FOLH1CYP1A2GRM3NAALAD2
SCHEMBL5054744 0.77 FOLH1 (0.61) FOLH1CYP1A2GRM3NAALAD2
SCHEMBL7608626 0.76 FOLH1 (0.60) FOLH1GRM3NAALAD2
SCHEMBL9814740 0.76 FOLH1 (0.48) FOLH1CYP1A2GRM3NAALAD2
SCHEMBL7608582 0.74 CPA3 (0.50) FOLH1CYP1A2NAALAD2
SCHEMBL9814887 0.74 FOLH1 (0.61) FOLH1GRM3NAALAD2
SCHEMBL7839040 0.74 FOLH1 (0.63) FOLH1CYP1A2GRM3NAALAD2
SCHEMBL7611637 0.74 FOLH1 (0.58) FOLH1CYP1A2GRM3NAALAD2
SCHEMBL7618177 0.74 FOLH1 (0.62) FOLH1GRM3NAALAD2
SCHEMBL7608459 0.72 CPA3 (0.63) FOLH1CYP1A2NAALAD2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6458775-B1 N-ACETYLATED .ALPHA.-LINKED ACIDIC DIPEPTIDASE (NAALADASE) INHIBITORS ENZYME ACTIVITY, PHARMACEUTICAL COMPOSITIONS COMPRISING SUCH INHIBITORS, AND METHODS OF THEIR USE TO INHIBIT NAALADASE ENZYME ACTIVITY, THEREBY EFFECTING NEURONAL GUILFORD PHARMACEUTICAL INC. 2002-10-01 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