SCHEMBL8713221

SCHEMBL8713221

COc1cc(C[O])cc(OC)c1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
PKM P14618 2/20 0.52
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA3 P07451 1/20 0.52
CA4 P22748 1/20 0.52
CA6 P23280 1/20 0.52
CA5A P35218 1/20 0.52
CA7 P43166 1/20 0.52
CA9 Q16790 1/20 0.52
CA14 Q9ULX7 1/20 0.52
CA5B Q9Y2D0 1/20 0.52
AKR1B1 P15121 1/20 0.52
GAA P10253 3/20 0.50
ALOX5 P09917 3/20 0.50
MAPT P10636 3/20 0.49
KDM4E B2RXH2 1/20 0.49
TNKS2 Q9H2K2 1/20 0.48
MET P08581 2/20 0.47

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
SCHEMBL7702890 0.81 AKR1B1 (0.55) LMNAPKMCA12CA1CA2
SCHEMBL16372690 0.81 AKR1B1 (0.71) LMNAPKMCA12CA1CA2
SCHEMBL901445 0.79 PTGS2 (0.64) LMNAPKMCA12CA1CA2
SCHEMBL1067240 0.79 TNKS2 (0.55) LMNAPKMCA12CA1CA2
SCHEMBL1587546 0.79 PTGS2 (0.64) CA12CA1CA2CA9CA14
SCHEMBL28708164 0.78 ALOX5 (0.56) LMNAPKMCA12CA1CA2
SCHEMBL4054977 0.78 MAPT (0.51) LMNAPKMCA12CA1CA2
SCHEMBL1999629 0.77 AKR1B1 (0.52) LMNAPKMCA12CA1CA2
SCHEMBL1999631 0.77 AKR1B1 (0.52) LMNAPKMCA12CA1CA2
SCHEMBL2002599 0.77 AKR1B1 (0.52) LMNAPKMCA12CA1CA2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0870088-A1 PROCESS FOR PREPARING A LIGNOCELLULOSE-BASED PRODUCT, AND PRODUCT OBTAINABLE BY THE PROCESS NOVO NORDISK A/S (DK) 1998-10-14 EP claimed
WO-1997017492-A1 PROCESS FOR PREPARING A LIGNOCELLULOSE-BASED PRODUCT, AND PRODUCT OBTAINABLE BY THE PROCESS NOVO NORDISK A/S (DK) 1997-05-15 WO claimed
EP-0870088-A1 PROCESS FOR PREPARING A LIGNOCELLULOSE-BASED PRODUCT, AND PRODUCT OBTAINABLE BY THE PROCESS NOVO NORDISK A/S (DK) 1998-10-14 EP disclosed
WO-1997017492-A1 PROCESS FOR PREPARING A LIGNOCELLULOSE-BASED PRODUCT, AND PRODUCT OBTAINABLE BY THE PROCESS NOVO NORDISK A/S (DK) 1997-05-15 WO disclosed