SCHEMBL13625379

SCHEMBL13625379

NCC(NC(=O)CCS)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GNPAT O15228 1/20 0.42
PTGS1 P23219 1/20 0.40
GSTK1 Q9Y2Q3 1/20 0.40
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
ALOX15 P16050 1/20 0.39
NFKB1 P19838 1/20 0.39
PTGS2 P35354 1/20 0.39
THPO P40225 1/20 0.39
RECQL P46063 1/20 0.39
BLM P54132 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
FNTA P49354 5/20 0.38
FNTB P49356 5/20 0.38
FOLH1 Q04609 3/20 0.38
NOD1 Q9Y239 3/20 0.38
SLC6A5 Q9Y345 1/20 0.36
ACE P12821 1/20 0.36
PGGT1B P53609 1/20 0.36

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
SCHEMBL12509112 0.87 GNPAT (0.43) GNPATPTGS1GSTK1FOLH1ACE
SCHEMBL15912290 0.87 GNPAT (0.43) GNPATPTGS1GSTK1FOLH1ACE
SCHEMBL13625380 0.85 GNPAT (0.47) GNPATPTGS1GSTK1KDM4EMAPT
SCHEMBL929193 0.83 KDM4E (0.57) GNPATPTGS1GSTK1KDM4EMAPT
SCHEMBL13471896 0.82 DNM1 (0.36) GNPATPTGS1GSTK1KDM4EMAPT
SCHEMBL13625463 0.82 FOLH1 (0.53) GNPATFNTAFNTBFOLH1NOD1
SCHEMBL11279985 0.82 TGFBR1 (0.48) GNPATPTGS1GSTK1KDM4EMAPT
SCHEMBL928640 0.82 GNPAT (0.47) GNPATPTGS1GSTK1KDM4EMAPT
SCHEMBL11269717 0.81 MEN1 (0.47) GNPATPTGS1GSTK1KDM4EMAPT
SCHEMBL13625464 0.80 FOLH1 (0.59) GNPATFNTAFNTBFOLH1NOD1

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-8937048-B2 Anti-angiogenic compounds COVX TECHNOLOGIES IRELAND, LIMITED (IE) 2015-01-20 US disclosed
WO-2009136352-A1 ANTI-ANGIOGENIC COMPOUNDS COVX TECHNOLOGIES IRELAND, LTD. (IE) 2009-11-12 WO disclosed