SCHEMBL8529367

SCHEMBL8529367

OCCSc1ccc(-c2ccc(SCCO)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.55
CA12 O43570 1/20 0.55
CA1 P00915 1/20 0.55
CA7 P43166 1/20 0.55
CA13 Q8N1Q1 1/20 0.55
SLC2A1 P11166 1/20 0.45
ALDH1A1 P00352 4/20 0.42
CDC25A P30304 3/20 0.42
CDC25B P30305 3/20 0.42
MAPK1 P28482 2/20 0.42
CDC25C P30307 2/20 0.42
APP P05067 2/20 0.40
KDM4E B2RXH2 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
S100A4 P26447 2/20 0.39
APAF1 O14727 1/20 0.39
MAP2K7 O14733 1/20 0.39
NPC1 O15118 1/20 0.39

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
SCHEMBL8637757 0.92 CA2 (0.61) CA2CA12CA1CA7CA13
SCHEMBL7996868 0.89 KDM4E (0.51) CA2CA12CA1CA7CA13
SCHEMBL3900894 0.84 CA2 (0.55) CA2CA12CA1CA7CA13
SCHEMBL811988 0.84 CA2 (0.66) CA2CA12CA1CA7CA13
SCHEMBL2589711 0.82 CA2 (0.53) CA2CA12CA1CA7CA13
SCHEMBL1710073 0.80 NPC1 (0.52) CA2CA12CA1CA7CA13
SCHEMBL5256127 0.80 CA2 (0.52) CA2CA12CA1CA7CA13
SCHEMBL9712031 0.80 CA2 (0.52) CA2CA12CA1CA7CA13
SCHEMBL7997051 0.80 CA2 (0.52) CA2CA12CA1CA7CA13
SCHEMBL7858651 0.80 CA2 (0.52) CA2CA12CA1CA7CA13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0868488-A1 NAPHTHALENEDICARBOXYLATE CONTAINING POLYESTER BLEND COMPOSITIONS HAVING REDUCED FLUORESCENCE EASTMAN CHEMICAL COMPANY (US) 1998-10-07 EP disclosed
EP-0799267-B1 NAPHTALENEDICARBOXYLIC ACID POLYMERS CONTAINING ARYL THIOETHERS AND HAVING REDUCED FLUORESCENCE EASTMAN CHEM CO (US) 1998-08-05 EP disclosed
US-5705600-A MELT BLENDING A POLYESTER AND POLYAMIDE WITH FLUORESCENCE QUENCHING COMPOUND EASTMAN CHEMICAL COMPANY (US) 1998-01-06 US disclosed
EP-0799267-A1 NAPHTALENEDICARBOXYLIC ACID POLYMERS CONTAINING ARYL THIOETHERS AND HAVING REDUCED FLUORESCENCE EASTMAN CHEMICAL COMPANY (US) 1997-10-08 EP disclosed
WO-1997023568-A1 NAPHTHALENEDICARBOXYLATE CONTAINING POLYESTER BLEND COMPOSITIONS HAVING REDUCED FLUORESCENCE EASTMAN CHEMICAL COMPANY (US) 1997-07-03 WO disclosed
WO-1997023569-A1 POLYESTER/NAPHTHALENEDICARBOXYLIC ACID-CONTAINING POLYMER BLENDS DISPLAYING REDUCED FLUORESCENCE EASTMAN CHEMICAL COMPANY (US) 1997-07-03 WO disclosed
US-5554720-A Naphthalenedicarboxylic acid polymers containing aryl thioethers and having reduced fluorescene EASTMAN CHEMICAL COMPANY (US) 1996-09-10 US disclosed
WO-1996019517-A1 NAPHTALENEDICARBOXYLIC ACID POLYMERS CONTAINING ARYL THIOETHERS AND HAVING REDUCED FLUORESCENCE EASTMAN CHEMICAL COMPANY (US) 1996-06-27 WO disclosed