SCHEMBL10899337

SCHEMBL10899337

CC(C)C1=CC(=O)c2cc3ccccc3cc2C1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.55
GAPDH P04406 1/20 0.49
CDC25A P30304 3/20 0.47
CDC25B P30305 3/20 0.47
HIF1A Q16665 4/20 0.44
EPAS1 Q99814 3/20 0.44
MEN1 O00255 2/20 0.40
LMNA P02545 2/20 0.40
GAA P10253 2/20 0.40
MAPK1 P28482 2/20 0.40
KMT2A Q03164 2/20 0.40
IDO1 P14902 2/20 0.40
PLIN1 O60240 1/20 0.40
NR1I2 O75469 1/20 0.40
USP2 O75604 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GSR P00390 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40

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
SCHEMBL11236085 0.86 GAPDH (0.47) PTPN1GAPDHCDC25ACDC25BHIF1A
SCHEMBL14567051 0.83 PTPN1 (0.47) PTPN1GAPDHCDC25ACDC25BHIF1A
SCHEMBL9627646 0.83 PTPN1 (0.70) PTPN1CDC25ACDC25BHIF1AEPAS1
SCHEMBL30038980 0.83 PTPN1 (0.70) PTPN1CDC25ACDC25BHIF1AEPAS1
SCHEMBL28108600 0.77 CDC25A (0.64) PTPN1GAPDHCDC25ACDC25BHIF1A
SCHEMBL10446178 0.76 ALDH1A1 (0.64) PTPN1GAPDHCDC25ACDC25BHIF1A
SCHEMBL10706935 0.75 GAPDH (0.60) PTPN1GAPDHCDC25ACDC25BHIF1A
SCHEMBL19459046 0.72 PTPN1 (0.80) PTPN1CDC25ACDC25BHIF1AMEN1
SCHEMBL28791428 0.72 HIF1A (0.42) PTPN1CDC25ACDC25BHIF1AEPAS1
SCHEMBL8661355 0.72 GAPDH (0.49) PTPN1GAPDHCDC25ACDC25BHIF1A

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-0178904-A2 Quinone synthesis ENERGY CONVERSION DEVICES, INC. (US) 1986-04-23 EP disclosed