SCHEMBL5820883

SCHEMBL5820883

CC(=O)OC(C)C1=CC(=O)c2ccccc2C1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.47
CTDSP1 Q9GZU7 1/20 0.47
CDC25A P30304 4/20 0.46
CDC25B P30305 4/20 0.46
IDO1 P14902 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
PLIN1 O60240 1/20 0.46
NR1I2 O75469 1/20 0.46
USP2 O75604 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GSR P00390 1/20 0.46
LMNA P02545 1/20 0.46
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
GAA P10253 1/20 0.46
CYP2D6 P10635 1/20 0.46
MAPT P10636 1/20 0.46

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
SCHEMBL5817375 0.77 PTPN1 (0.55) PTPN1CTDSP1CDC25ACDC25BIDO1
SCHEMBL9627646 0.76 PTPN1 (0.70) PTPN1CTDSP1CDC25ACDC25BIDO1
SCHEMBL30038980 0.76 PTPN1 (0.70) PTPN1CTDSP1CDC25ACDC25BIDO1
SCHEMBL5810766 0.76 PTPN1 (0.59) PTPN1CTDSP1CDC25ACDC25BIDO1
SCHEMBL29551453 0.76 CDC25A (0.55) PTPN1CTDSP1CDC25ACDC25BIDO1
SCHEMBL5822235 0.73 CDC25B (0.46) CDC25ACDC25BMEN1KMT2AALDH1A1
SCHEMBL637237 0.72 S100A4 (0.63) PTPN1CDC25ACDC25BIDO1MEN1
SCHEMBL30661169 0.72 S100A4 (0.63) PTPN1CDC25ACDC25BIDO1MEN1
SCHEMBL28514269 0.72 CDC25B (0.56) PTPN1CTDSP1CDC25ACDC25BIDO1
SCHEMBL9628284 0.70 PTPN1 (0.52) PTPN1CTDSP1CDC25ACDC25BIDO1

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
WO-2006107827-A1 SKIN BONDING PROCESS CREIGHTON UNIVERSITY (US) 2006-10-12 WO disclosed