SCHEMBL4598277

SCHEMBL4598277

CCCC(F)OC(=O)n1nnc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ASAH1 Q13510 1/20 0.51
▸ GAA P10253 9/20 0.49
▸ MGAM O43451 8/20 0.49
▸ AMY1A P0DUB6 8/20 0.49
▸ SI P14410 8/20 0.49
▸ MGAM2 Q2M2H8 8/20 0.49
▸ KMT2A Q03164 4/20 0.46
▸ F2 P00734 2/20 0.46
▸ HPGD P15428 1/20 0.46
▸ SLC9A1 P19634 1/20 0.46
▸ HTT P42858 2/20 0.45
▸ NPSR1 Q6W5P4 2/20 0.45
▸ MITF O75030 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ F12 P00748 4/20 0.45
▸ MIF P14174 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.45

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
SCHEMBL14639695 0.79 GAA (0.54) GAAMGAMAMY1ASIMGAM2
SCHEMBL2115731 0.78 GAA (0.58) ASAH1GAAMGAMAMY1ASI
SCHEMBL14193247 0.77 GAA (0.57) ASAH1GAAMGAMAMY1ASI
SCHEMBL10365955 0.75 GAA (0.49) GAAMGAMAMY1ASIMGAM2
SCHEMBL3944546 0.75 MGAM (0.65) ASAH1GAAMGAMAMY1ASI
SCHEMBL459733 0.74 GAA (0.60) ASAH1GAAMGAMAMY1ASI
SCHEMBL27397872 0.74 MGAM (0.54) ASAH1GAAMGAMAMY1ASI
SCHEMBL9601344 0.73 ASAH1 (0.62) ASAH1GAAMGAMAMY1ASI
SCHEMBL11490925 0.73 ASAH1 (0.62) ASAH1GAAMGAMAMY1ASI
SCHEMBL27972637 0.73 ASAH1 (0.62) ASAH1GAAMGAMAMY1ASI

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
EP-1910340-A1 INDAZOLECARBOXAMIDE DERIVATIVES AS 5HT4 RECEPTOR AGONISTS Pfizer, Inc. (US) 2008-04-16 — — EP disclosed
EP-1856110-A1 OXYINDOLE DERIVATIVES AS 5HT4 RECEPTOR AGONISTS Pfizer, Inc. (US) 2007-11-21 — — EP disclosed
EP-1758891-A2 BENZIMIDAZOLONE CARBOXYLIC ACID DERIVATIVES Pfizer Japan Inc. (JP) 2007-03-07 — — EP disclosed
WO-2007010390-A1 INDAZOLECARBOXAMIDE DERIVATIVES AS 5HT4 RECEPTOR AGONISTS PFIZER JAPAN INC. (JP) 2007-01-25 — — WO disclosed
WO-2006090279-A1 OXYINDOLE DERIVATIVES AS 5HT4 RECEPTOR AGONISTS PFIZER JAPAN INC. (JP) 2006-08-31 — — WO disclosed
WO-2005123718-A2 BENZIMIDAZOLONE CARBOXYLIC ACID DERIVATIVES PFIZER JAPAN INC. (JP) 2005-12-29 — — WO disclosed
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