SCHEMBL15215211

SCHEMBL15215211

CCC(CC)COS(=O)(=O)O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.40
CA1 P00915 2/20 0.40
CA12 O43570 1/20 0.40
CA7 P43166 1/20 0.40
CA14 Q9ULX7 1/20 0.40
RECQL P46063 1/20 0.35
TSHR P16473 2/20 0.32
CA9 Q16790 1/20 0.31
CYP3A4 P08684 1/20 0.31
ATM Q13315 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL1892146 0.84 CA2 (0.37) CA2CA1CA12CA7CA14
Ethasulfuric Acid SCHEMBL188420 0.83 RECQL (0.54) CA2CA1CA12CA7CA14
Ethasulfuric Acid SCHEMBL25393494 0.82 RECQL (0.53) CA2CA1CA12CA7CA14
SCHEMBL11132006 0.82 RECQL (0.49) CA2CA1CA12CA7CA14
Ethasulfuric Acid SCHEMBL670642 0.82 RECQL (0.53) CA2CA1CA12CA7CA14
Ethasulfuric Acid SCHEMBL17456532 0.82 RECQL (0.53) CA2CA1CA12CA7CA14
Ethasulfuric Acid SCHEMBL28070682 0.82 RECQL (0.53) CA2CA1CA12CA7CA14
SCHEMBL3459665 0.80 RECQL (0.48) CA2CA1CA12CA7CA14
SCHEMBL30151127 0.80 RECQL (0.48) CA2CA1CA12CA7CA14
SCHEMBL25277313 0.80 RECQL (0.48) CA2CA1CA12CA7CA14

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
US-9760060-B2 Photopolymer formulations for producing holographic media having highly crosslinked matrix polymers COVESTRO DEUTSCHLAND AG (DE) 2017-09-12 US disclosed
US-20170137745-A1 CLEANING COMPOSITIONS CONTAINING A BRANCHED ALKYL SULFATE SURFACTANT AND A SHORT-CHAIN NONIONIC SURFACTANT THE PROCTER & GAMBLE COMPANY 2017-05-18 US disclosed
US-20170137748-A1 CLEANING COMPOSITIONS CONTAINING BRANCHED ALKYL SULFATE SURFACTANT WITH LITTLE OR NO ALKOXYLATED ALKYL SULFATE THE PROCTER & GAMBLE COMPANY 2017-05-18 US disclosed
US-9146456-B2 Photopolymer formulation for producing holographic media having highly crosslinked matrix polymers BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-09-29 US disclosed
US-20130224634-A1 PHOTOPOLYMER FORMULATION FOR PRODUCING HOLOGRAPHIC MEDIA HAVING HIGHLY CROSSLINKED MATRIX POLYMERS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-08-29 US disclosed