SCHEMBL8374307

SCHEMBL8374307

COS(=O)(=S)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.55
CA9 Q16790 6/20 0.55
CA1 P00915 5/20 0.55
TSHR P16473 2/20 0.41
ALDH1A1 P00352 2/20 0.41
AR P10275 3/20 0.39
NPC1 O15118 1/20 0.39
HPGD P15428 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
IDO1 P14902 1/20 0.39
CA12 O43570 2/20 0.39
CA4 P22748 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
CA5B Q9Y2D0 1/20 0.39
HTT P42858 1/20 0.38
AGXT P21549 1/20 0.38
MAOB P27338 1/20 0.37
PRSS1 P07477 2/20 0.37

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
SCHEMBL28246768 0.88 CA2 (0.63) CA2CA9CA1TSHRALDH1A1
SCHEMBL9861122 0.81 CA2 (0.55) CA2CA9CA1TSHRALDH1A1
SCHEMBL4332693 0.80 CA2 (0.59) CA2CA9CA1TSHRALDH1A1
SCHEMBL5467517 0.80 CA2 (0.59) CA2CA9CA1TSHRALDH1A1
SCHEMBL9861791 0.79 CA2 (0.53) CA2CA9CA1TSHRAR
Ammonia Solution, Strong SCHEMBL29090853 0.78 CA2 (0.57) CA2CA9CA1TSHRALDH1A1
SCHEMBL5078811 0.76 CA2 (0.59) CA2CA9CA1TSHRALDH1A1
SCHEMBL249386 0.75 CA2 (0.63) CA2CA9CA1TSHRALDH1A1
Benzene SCHEMBL27447210 0.75 CA2 (0.63) CA2CA9CA1TSHRALDH1A1
SCHEMBL6212518 0.75 CA2 (0.49) CA2CA9CA1TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1330765-C Polycationic water-soluble copolymers and methods for delivering polyanionic macromolecules across biological barriers SALUS THERAPEUTICS (US) 2007-08-08 CN disclosed
CN-1617928-A Polycationic water soluble copolymer and method for transferring polyanionic macromolecules across biological barriers SALUS THERAPEUTICS (US) 2005-05-18 CN disclosed
EP-0923387-A2 HEPARINIZED MEDICAL DEVICES CONTAINING HEPARIN-BINDING GROWTH FACTOR CONJUGATES Selective Genetics, Inc. (US) 1999-06-23 EP disclosed
WO-1997049434-A9 HEPARINIZED MEDICAL DEVICES CONTAINING HEPARIN-BINDING GROWTH FACTOR CONJUGATES 1998-05-07 WO disclosed
WO-1997049434-A2 HEPARINIZED MEDICAL DEVICES CONTAINING HEPARIN-BINDING GROWTH FACTOR CONJUGATES PRIZM PHARMACEUTICALS, INC. (US) 1997-12-31 WO disclosed