SCHEMBL543417

SCHEMBL543417

CN(CC(C)(C)C=O)C1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 11/20 0.45
ADH1C P00326 8/20 0.45
ADH1B P00325 2/20 0.37
HRH4 Q9H3N8 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ADH4 P08319 2/20 0.34
RAB9A P51151 1/20 0.33
ADH7 P40394 1/20 0.31
HSD11B1 P28845 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL2557357 0.90 ADH1C (0.31) ADH1AADH1C
SCHEMBL9283512 0.77 HRH3 (0.42) ADH1AADH1CHRH4HRH3KDM4E
SCHEMBL9283576 0.74 HRH3 (0.39) ADH1AADH1CHRH4HRH3KDM4E
SCHEMBL15387169 0.74 HRH3 (0.40) ADH1AADH1CHRH4HRH3KDM4E
SCHEMBL20096008 0.74 HRH4 (0.40) ADH1AADH1CHRH4HRH3KDM4E
SCHEMBL29957190 0.73 ADH1A (0.54) ADH1AADH1CADH1BHRH4HRH3
SCHEMBL3938593 0.73 ADH1A (0.54) ADH1AADH1CADH1BHRH4HRH3
SCHEMBL24927586 0.72 HRH3 (0.39) ADH1AADH1CHRH4HRH3KDM4E
SCHEMBL9283514 0.72 HRH4 (0.36) ADH1AADH1CHRH4HRH3KDM4E
SCHEMBL2247231 0.72 ADH1A (0.38) ADH1AADH1CADH1B

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103261146-B Polyamines having secondary aliphatic amino groups SIKA TECHNOLOGY AG (CH) 2016-01-27 CN claimed
CN-103313995-A Secondary aminosilanes SIKA TECHNOLOGY AG 2013-09-18 CN claimed
CN-103261146-A Polyamines having secondary aliphatic amino groups SIKA TECHNOLOGY AG 2013-08-21 CN claimed
US-12209157-B2 Polyurethane composition having a low content of monomeric diisocyantes SIKA TECHNOLOGY AG (CH) 2025-01-28 US disclosed
CN-112533972-B Polyurethane compositions with low levels of monomeric diisocyanates SIKA技术股份公司 2023-05-23 CN disclosed
CN-109563232-B Two-component polyurethane adhesive with mechanical properties substantially unaffected by temperature and high strength SIKA技术股份公司 2022-04-12 CN disclosed
US-11149106-B2 Two-component polyurethane adhesive having substantially temperature-independent mechanical properties and high strength SIKA TECHNOLOGY AG (CH) 2021-10-19 US disclosed
US-20210309787-A1 POLYURETHANE COMPOSITION HAVING A LOW CONTENT OF MONOMERIC DIISOCYANTES SIKA TECHNOLOGY AG (CH) 2021-10-07 US disclosed
EP-3833701-A1 POLYURETHANE COMPOSITION HAVING A LOW CONTENT OF MONOMERIC DIISOCYANTES Sika Technology AG (CH) 2021-06-16 EP disclosed
CN-112533972-A Polyurethane compositions with low content of monomeric diisocyanates SIKA技术股份公司 2021-03-19 CN disclosed
EP-3494155-B1 TWO COMPONENT POLYURETHANE ADHESIVE WITH SUBSTANTIALLY TEMPERATURE INDEPENDENT MECHANICAL PROPERTIES AND HIGH STRENGTH SIKA TECH AG (CH) 2020-09-09 EP disclosed
CN-102421816-B Hot curing or heat-activated composition containing a surface-deactivated polyisocyanate SIKA TECHNOLOGY AG 2014-07-09 CN disclosed
CN-102421817-B Composition containing a surface-deactivated polyisocyanate and curing in two stages SIKA TECHNOLOGY AG 2014-05-07 CN disclosed
CN-103313995-A Secondary aminosilanes SIKA TECHNOLOGY AG 2013-09-18 CN disclosed
CN-103261146-A Polyamines having secondary aliphatic amino groups SIKA TECHNOLOGY AG 2013-08-21 CN disclosed
CN-102421816-A Heat-curable or heat-activatable compositions comprising surface-deactivated polyisocyanates SIKA TECHNOLOGY AG 2012-04-18 CN disclosed
CN-102421817-A Two-stage curing composition comprising a surface-deactivated polyisocyanate SIKA TECHNOLOGY AG 2012-04-18 CN disclosed
EP-2414418-A1 COMPOSITION CONTAINING A SURFACE-DEACTIVATED POLYISOCYANATE AND CURING IN TWO STAGES Sika Technology AG (CH) 2012-02-08 EP disclosed
WO-2010112537-A1 COMPOSITION CONTAINING A SURFACE-DEACTIVATED POLYISOCYANATE AND CURING IN TWO STAGES SIKA TECHNOLOGY AG (CH) 2010-10-07 WO disclosed
CN-101687775-A Aldimines and compositions comprising aldamine SIKA TECHNOLOGY AG 2010-03-31 CN disclosed