SCHEMBL3698550

SCHEMBL3698550

C=CCCC(C)S(=O)(=O)O

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.33
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
FAAH O00519 1/20 0.31
TSHR P16473 2/20 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
SCHEMBL31715459 0.84 ALDH1A1 (0.41) TP53TSHR
Fluoride SCHEMBL27497656 0.82 ALDH1A1 (0.40) TP53TSHR
Imidazole SCHEMBL28071924 0.79 ALDH1A1 (0.37)
SCHEMBL26909738 0.79 TP53 (0.34) TP53
Imidazole SCHEMBL28799226 0.78 ALDH1A1 (0.36)
SCHEMBL18425643 0.77 CA2 (0.40) CA2CA9TSHR
SCHEMBL17550268 0.77 CA2 (0.40) CA2CA9TSHR
SCHEMBL17550269 0.77 CA2 (0.40) CA2CA9TSHR
SCHEMBL27749721 0.77 TP53 (0.33) TP53
SCHEMBL14955034 0.77 TP53 (0.42) TP53

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
CN-105618149-A Preparation method of porous polyion liquid catalyst for synthesizing biodiesel NANJING UNIVERSITY OF TECHNOLOGY 2016-06-01 CN claimed
CN-114805028-B Method for removing trace aldehyde impurities in 1, 3-propylene glycol 万华化学集团股份有限公司 2023-07-14 CN disclosed
CN-114805028-A Method for removing trace aldehyde group impurities in 1, 3-propylene glycol 万华化学集团股份有限公司 2022-07-29 CN disclosed
CN-105618149-A Preparation method of porous polyion liquid catalyst for synthesizing biodiesel NANJING UNIVERSITY OF TECHNOLOGY 2016-06-01 CN disclosed
CN-101045769-B Copolymer containing functional group of sulfonic acid or its salt, and process for producing the copolymer SUMITOMO CHEMICAL CO 2011-06-08 CN disclosed
US-7816474-B2 Copolymer containing functional group of sulfonic acid or its salt, and process for producing said copolymer SUMITOMO CHEMCIAL COMPANY, LIMITED (JP) 2010-10-19 US disclosed
US-20070232767-A1 Copolymer containing functional group of sulfonic acid or its salt, and process for producing said copolymer SUMITOMO CHEMICAL COMPANY, LIMITED 2007-10-04 US disclosed
CN-101045769-A Copolymer containing functional group of sulfonic acid or its salt, and process for producing the copolymer SUMITOMO CHEMICAL CO (JP) 2007-10-03 CN disclosed