SCHEMBL9469378

SCHEMBL9469378

Oc1c(-c2ccccc2)cc(-c2cc(-c3ccccc3)c(O)c(-c3ccccc3)c2-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.52
PDE4B Q07343 4/20 0.50
HDAC4 P56524 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
PDE4A P27815 3/20 0.46
PDE4C Q08493 3/20 0.46
PDE4D Q08499 3/20 0.46
PTPN1 P18031 4/20 0.46
ALOX5 P09917 1/20 0.45
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
BCL2L1 Q07817 1/20 0.44
HSD17B10 Q99714 1/20 0.44
HNF4A P41235 1/20 0.44
AKR1C3 P42330 1/20 0.43
AKR1C2 P52895 1/20 0.43
AKR1C1 Q04828 1/20 0.43
LMNA P02545 1/20 0.42

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
SCHEMBL4326249 0.91 BACE1 (0.56) BACE1PDE4BHDAC4HDAC2HDAC8
SCHEMBL28275162 0.85 PDE4B (0.42) BACE1PDE4BHDAC4HDAC2HDAC8
SCHEMBL1760415 0.84 PDE4B (0.62) BACE1PDE4BHDAC4HDAC2HDAC8
SCHEMBL10338501 0.82 BACE1 (0.52) BACE1PDE4BHDAC4HDAC2HDAC8
SCHEMBL1524220 0.81 BACE1 (0.56) BACE1PDE4BHDAC4HDAC2HDAC8
SCHEMBL9469342 0.81 PDE4B (0.50) BACE1PDE4BHDAC4HDAC2HDAC8
SCHEMBL7634679 0.80 BACE1 (0.62) BACE1PDE4BHDAC4HDAC2HDAC8
SCHEMBL9236954 0.80 BACE1 (0.62) BACE1PDE4BHDAC4HDAC2HDAC8
SCHEMBL20323159 0.78 MMP3 (0.56) BACE1PDE4BPDE4APDE4CPDE4D
SCHEMBL4647831 0.78 HDAC4 (0.54) BACE1PDE4BHDAC4HDAC2HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5243016-A Improved solubility, polyimides, polyether ketones, polyesters, polyether sulfones HAY ALLAN S (CA) 1993-09-07 US disclosed
US-5182358-A Polyetherketones, polyethersulfone, polyetherimides, solubility in organic solvents HAY ALLAN S (CA) 1993-01-26 US disclosed