SCHEMBL27561990

SCHEMBL27561990

O=C(O)CCC(C(=O)O)C(S)(S)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 11/20 0.46
TET2 Q6N021 3/20 0.43
KDM4A O75164 2/20 0.43
KDM4C Q9H3R0 2/20 0.43
KDM2A Q9Y2K7 2/20 0.43
TET3 O43151 1/20 0.43
CYP1A2 P05177 2/20 0.41
GRM8 O00222 1/20 0.41
GRM6 O15303 1/20 0.41
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GSR P00390 1/20 0.41
GRIK1 P39086 1/20 0.41
GRM5 P41594 1/20 0.41
GRIA1 P42261 1/20 0.41
GRIA2 P42262 1/20 0.41
GRIA3 P42263 1/20 0.41
SLC1A3 P43003 1/20 0.41
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41

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
SCHEMBL4150436 0.76 FOLH1 (0.42) FOLH1TET2KDM4AKDM4CKDM2A
SCHEMBL1231740 0.73 CYP1A2 (0.50) FOLH1TET2KDM4AKDM4CKDM2A
SCHEMBL27935875 0.73 TET2 (0.46) FOLH1TET2KDM4AKDM4CKDM2A
SCHEMBL5929523 0.72 CYP1A2 (0.45) FOLH1TET2KDM4AKDM4CKDM2A
Ammonia Solution, Strong SCHEMBL29572919 0.71 TET2 (0.44) FOLH1TET2KDM4AKDM4CKDM2A
SCHEMBL669817 0.65 FOLH1 (0.64) FOLH1TET2KDM4AKDM4CKDM2A
SCHEMBL1751707 0.64
SCHEMBL535764 0.64
SCHEMBL1874484 0.64 FOLH1 (1.00) FOLH1TET2KDM4AKDM4CKDM2A
SCHEMBL1752169 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1314882-A NAALADase inhibitors and compositions as pharmaceutical compounds GUILFORD PHARM INC (US) 2001-09-26 CN disclosed