SCHEMBL9469342

SCHEMBL9469342

Cc1c(-c2cc(-c3ccccc3)c(O)c(-c3ccccc3)c2C)cc(-c2ccccc2)c(O)c1-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 4/20 0.50
BACE1 P56817 2/20 0.46
PDE4A P27815 3/20 0.46
PDE4C Q08493 3/20 0.46
PDE4D Q08499 3/20 0.46
ESR2 Q92731 1/20 0.46
HDAC4 P56524 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
SENP1 Q9P0U3 1/20 0.42
PTPN1 P18031 2/20 0.42
HK2 P52789 1/20 0.41
ALOX5 P09917 1/20 0.41
ALDH1A1 P00352 2/20 0.40
HPGD P15428 1/20 0.40
BCL2L1 Q07817 1/20 0.40
HSD17B10 Q99714 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
SCHEMBL4326249 0.85 BACE1 (0.56) PDE4BBACE1PDE4APDE4CPDE4D
SCHEMBL9469378 0.81 BACE1 (0.52) PDE4BBACE1PDE4APDE4CPDE4D
SCHEMBL8350739 0.80 PTPN1 (0.56) PDE4BBACE1HDAC4HDAC2HDAC8
SCHEMBL10338501 0.77 BACE1 (0.52) PDE4BBACE1PDE4APDE4CPDE4D
SCHEMBL1524220 0.76 BACE1 (0.56) PDE4BBACE1PDE4APDE4CPDE4D
SCHEMBL9329605 0.76 KMT2A (0.41) PDE4BBACE1PDE4APDE4CPDE4D
SCHEMBL7634679 0.75 BACE1 (0.62) PDE4BBACE1ESR2HDAC4HDAC2
SCHEMBL1760415 0.75 PDE4B (0.62) PDE4BBACE1PDE4APDE4CPDE4D
SCHEMBL9469704 0.75 ESR2 (0.53) PDE4BBACE1PDE4APDE4CPDE4D
SCHEMBL27493715 0.74 ESR2 (0.48) PDE4BBACE1PDE4APDE4CPDE4D

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