SCHEMBL3264736

SCHEMBL3264736

O=C(O)CC(Cn1nnc2c(C(=O)O)cccc21)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APAF1 O14727 1/20 0.41
POLB P06746 1/20 0.41
GRM2 Q14416 4/20 0.40
FOLH1 Q04609 1/20 0.37
CPA1 P15085 2/20 0.37
CPB1 P15086 1/20 0.37
CPA3 P15088 1/20 0.37
CPB2 Q96IY4 1/20 0.37
EGLN3 Q9H6Z9 1/20 0.35
ALDH1A1 P00352 1/20 0.33
MGAM O43451 3/20 0.33
AMY1A P0DUB6 3/20 0.33
GAA P10253 3/20 0.33
SI P14410 3/20 0.33
MGAM2 Q2M2H8 3/20 0.33
FGFR1 P11362 2/20 0.32
FGFR4 P22455 2/20 0.32
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL29393597 0.79 APAF1 (0.66) APAF1POLBGRM2EGLN3ALDH1A1
SCHEMBL240665 0.79 APAF1 (0.66) APAF1POLBGRM2EGLN3ALDH1A1
SCHEMBL16610475 0.76 GRM2 (0.40) GRM2EGLN3ALDH1A1MGAMAMY1A
SCHEMBL28411473 0.72 GRM2 (0.62) GRM2EGLN3ALDH1A1
SCHEMBL9138969 0.71 PTGES (0.49) GRM2ALDH1A1GAAKEAP1
SCHEMBL15517000 0.70 GRM2 (0.35) GRM2EGLN3ALDH1A1MGAMAMY1A
SCHEMBL11490926 0.70 GRM2 (0.56) GRM2ALDH1A1
SCHEMBL2857242 0.70 GRM2 (0.39) APAF1POLBGRM2ALDH1A1MGAM
SCHEMBL724308 0.70 MAPK1 (0.51) POLBALDH1A1TSHRRAB9A
SCHEMBL10347831 0.68 ALDH1A1 (0.42) ALDH1A1TSHRRAB9A

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
EP-1124912-B1 A CHEMICAL MECHANICAL POLISHING SLURRY SYSTEM HAVING AN ACTIVATOR SOLUTION FUJIFILM ELECTRONIC MATERIALS (US) 2010-07-21 EP disclosed