SCHEMBL357086

SCHEMBL357086

CCCCCCCCCCCCCC(=O)N1C(=O)c2ccccc2S1(=O)=O

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 8/20 0.57
CA12 O43570 7/20 0.57
CYP2D6 P10635 1/20 0.51
TSHR P16473 1/20 0.51
FBP1 P09467 5/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC2 Q92769 1/20 0.49
CA2 P00918 4/20 0.48
ELANE P08246 2/20 0.45

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
SCHEMBL5851731 1.00 CA9 (0.57) CA9CA12CYP2D6TSHRFBP1
SCHEMBL356623 1.00 CA9 (0.57) CA9CA12CYP2D6TSHRFBP1
SCHEMBL357966 1.00 CA9 (0.57) CA9CA12CYP2D6TSHRFBP1
SCHEMBL357275 1.00 CA9 (0.57) CA9CA12CYP2D6TSHRFBP1
SCHEMBL356668 1.00 CA9 (0.57) CA9CA12CYP2D6TSHRFBP1
SCHEMBL358978 0.99 CA9 (0.58) CA9CA12CYP2D6TSHRFBP1
SCHEMBL7803782 0.94 CA9 (0.57) CA9CA12CYP2D6TSHRFBP1
SCHEMBL12591546 0.93 CYP2D6 (0.57) CA9CA12CYP2D6TSHRFBP1
SCHEMBL359517 0.89 CYP2D6 (0.56) CA9CA12CYP2D6TSHRFBP1
SCHEMBL12592558 0.89 CYP2D6 (0.59) CA9CA12CYP2D6TSHRFBP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8980163-B2 Process for producing plastic bottle ADEKA CORPORATION (JP) 2015-03-17 US disclosed
EP-2423260-B1 PROCESS FOR PRODUCING PLASTIC BOTTLE ADEKA CORP (JP) 2013-12-04 EP disclosed
EP-2423260-A1 PROCESS FOR PRODUCING PLASTIC BOTTLE Adeka Corporation (JP) 2012-02-29 EP disclosed
US-20120013049-A1 PROCESS FOR PRODUCING PLASTIC BOTTLE ADEKA CORPORATION (JP) 2012-01-19 US disclosed