SCHEMBL6898678

SCHEMBL6898678

O=C(O)C(CS)NCC1CO1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
ALOX15 P16050 1/20 0.41
NFKB1 P19838 1/20 0.41
PTGS2 P35354 1/20 0.41
THPO P40225 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ACE P12821 1/20 0.38
FOLH1 Q04609 1/20 0.36
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
PTGS1 P23219 1/20 0.30
SLC7A11 Q9UPY5 1/20 0.30
CPN1 P15169 1/20 0.30
CPB2 Q96IY4 1/20 0.30

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
SCHEMBL6903808 1.00 KDM4E (0.41) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL28461929 0.79 ALDH1A1 (0.46) MAPTFOLH1
SCHEMBL28461928 0.79 ALDH1A1 (0.46) MAPTFOLH1
SCHEMBL8894666 0.79 FOLH1 (0.47) FOLH1
SCHEMBL8894663 0.79 FOLH1 (0.47) FOLH1
SCHEMBL5397395 0.77 KDM4E (0.44) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL2346068 0.73 SMN1; SMN2 (0.39) KDM4ESMN1; SMN2ACE
SCHEMBL2346066 0.73 SMN1; SMN2 (0.39) KDM4ESMN1; SMN2ACE
SCHEMBL21224186 0.72 MEN1 (0.47) ACEFOLH1
SCHEMBL900178 0.71 KDM4E (0.54) KDM4EMAPTTHRBALOX15NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6806362-B2 ADSORPTION, DESORPTION OF TARGETED NUCLEIC ACIDS PROMEGA CORPORATION 2004-10-19 US disclosed
EP-1179057-B1 pH DEPENDENT ION EXCHANGE MATRIX AND METHOD OF USE IN THE ISOLATION OF NUCLEIC ACIDS PROMEGA CORP (US) 2004-07-21 EP disclosed
EP-1179057-A2 pH DEPENDENT ION EXCHANGE MATRIX AND METHOD OF USE IN THE ISOLATION OF NUCLEIC ACIDS PROMEGA CORPORATION (US) 2002-02-13 EP disclosed
US-6310199-B1 BY ADSORBING TO THE TARGET NUCLEIC ACID AT AN ADSORPTION PH AND RELEASING THE TARGET NUCLEIC ACID AT A DESORPTION PH WHICH IS HIGHER THAN THE ADSORPTION PH; MAGNETIC SILIA PARTICLES; GLYCIDYL LIGANDS; AMINO ACID LIGANDS; SPACERS PROMEGA CORPORATION 2001-10-30 US disclosed
US-20010014650-A1 pH dependent ion exchange matrix and method of use in the isolation of nucleic acids PROMEGA CORPORATION (US) 2001-08-16 US disclosed
WO-2000069872-A2 pH DEPENDENT ION EXCHANGE MATRIX AND METHOD OF USE IN THE ISOLATION OF NUCLEIC ACIDS PROMEGA CORPORATION (US) 2000-11-23 WO disclosed