SCHEMBL5810487

SCHEMBL5810487

CC(=O)OC1=CC(=O)c2cc(OC(C)=O)ccc2C1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 1/20 0.44
S100A4 P26447 1/20 0.43
BACE1 P56817 2/20 0.43
GAPDH P04406 2/20 0.41
POLB P06746 2/20 0.41
PKM P14618 1/20 0.41
KDM4E B2RXH2 4/20 0.41
CA12 O43570 2/20 0.41
GLA P06280 2/20 0.41
CA9 Q16790 2/20 0.41
GAA P10253 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
CYP3A4 P08684 2/20 0.41
TTR P02766 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL11213111 0.81 MAPT (0.55) MAPTSMN1; SMN2ALDH1A1BACE1GAPDH
SCHEMBL14566869 0.81 GAPDH (0.58) MAPTSMN1; SMN2ALDH1A1S100A4BACE1
SCHEMBL637237 0.80 S100A4 (0.63) MAPTSMN1; SMN2ALDH1A1S100A4BACE1
SCHEMBL30661169 0.80 S100A4 (0.63) MAPTSMN1; SMN2ALDH1A1S100A4BACE1
SCHEMBL10377985 0.78 LMNA (0.47) MAPTSMN1; SMN2ALDH1A1BACE1GAPDH
SCHEMBL22336250 0.78 MAPT (0.55) MAPTSMN1; SMN2ALDH1A1BACE1POLB
SCHEMBL27989381 0.78 PTPN1 (0.59) MAPTSMN1; SMN2ALDH1A1BACE1POLB
SCHEMBL15085173 0.77 MAPT (0.62) MAPTSMN1; SMN2ALDH1A1BACE1POLB
SCHEMBL4642778 0.76 MAPT (0.61) MAPTSMN1; SMN2ALDH1A1S100A4BACE1
SCHEMBL30003084 0.73 IDO1 (0.62) MAPTALDH1A1GAPDHCA9MEN1

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