SCHEMBL9872504

SCHEMBL9872504

CC(C)NC(C)OC(C)O

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 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
SCHEMBL720628 0.88 ALDH1A1 (0.31)
SCHEMBL2058252 0.82 MAPK1 (0.30)
SCHEMBL11535662 0.78
SCHEMBL10609151 0.74 TSHR (0.36) TDP1
SCHEMBL28280749 0.74 TSHR (0.36) TDP1
SCHEMBL5611388 0.73
SCHEMBL15253573 0.71 TSHR (0.33)
SCHEMBL11866595 0.71 TSHR (0.36)
SCHEMBL11137367 0.71 TSHR (0.33)
SCHEMBL40263 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5001267-A Secondary alkyl amine derivatives of ethylenediamine TEXACO CHEMICAL COMPANY (US) 1991-03-19 US disclosed
EP-0388045-A1 Secondary alkyl amine derivatives of ethylenediamine TEXACO DEVELOPMENT CORPORATION (US) 1990-09-19 EP disclosed
EP-0084943-B2 SECONDARY AND TERTIARY AMINO ALCOHOLS EXXON RESEARCH AND ENGINEERING COMPANY (US) 1989-08-02 EP disclosed
US-4665234-A AMINATION OF HALOALKOXYALKANOL WITH HINDERED ALKYLAMINE EXXON RESEARCH AND ENGINEERING COMPANY (US) 1987-05-12 US disclosed
EP-0084943-B1 SECONDARY AND TERTIARY AMINO ALCOHOLS EXXON RESEARCH AND ENGINEERING COMPANY (US) 1986-04-02 EP disclosed
EP-0087208-B1 A PROCESS FOR REMOVAL OF HYDROGEN SULFIDE FROM GASEOUS MIXTURES WITH SEVERELY STERICALLY HINDERED SECONDARY AMINO COMPOUNDS EXXON RESEARCH AND ENGINEERING COMPANY (US) 1986-02-26 EP disclosed
US-4471138-A Severely sterically hindered secondary aminoether alcohols EXXON RESEARCH AND ENGINEERING CO. (US) 1984-09-11 US disclosed
US-4405585-A Process for the selective removal of hydrogen sulfide from gaseous mixtures with severely sterically hindered secondary aminoether alcohols EXXON RESEARCH AND ENGINEERING CO. (US) 1983-09-20 US disclosed
EP-0087208-A1 A process for removal of hydrogen sulfide from gaseous mixtures with severely sterically hindered secondary amino compounds EXXON RESEARCH AND ENGINEERING COMPANY (US) 1983-08-31 EP disclosed
EP-0084943-A2 Secondary and tertiary amino alcohols EXXON RESEARCH AND ENGINEERING COMPANY (US) 1983-08-03 EP disclosed