SCHEMBL2497813

SCHEMBL2497813

CCCCN(CC)COCC

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA9 Q16790 2/20 0.34
KCNH2 Q12809 8/20 0.34
PLA2G1B P04054 1/20 0.33
PLA2G2A P14555 1/20 0.33
HTR1D P28221 1/20 0.33
HTR1B P28222 1/20 0.33

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
SCHEMBL2497255 0.90 CA12 (0.34) KDM5AKDM4CCA12CA1CA9
SCHEMBL2496151 0.86 CA12 (0.32) KDM5AKDM4CCA12CA1CA9
SCHEMBL2494291 0.85 MEN1 (0.32) KCNH2
SCHEMBL347977 0.85 CA12 (0.39) KDM5AKDM4CCA12CA1CA9
Ether SCHEMBL27695907 0.79 KDM5A (0.39) KDM5AKDM4CCA12CA1CA9
SCHEMBL2498447 0.79
SCHEMBL2499595 0.78 CA12 (0.35) KDM5AKDM4CCA12CA1CA9
SCHEMBL217114 0.76 KCNH2 (0.47) KDM5AKDM4CCA12CA1CA9
SCHEMBL22725 0.76
SCHEMBL347018 0.75 CA12 (0.34) CA12CA1CA9HTR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2072496-B1 METHOD FOR PRODUCING HIGH-PURITY QUATERNARY AMMONIUM SALT OTSUKA CHEMICAL CO LTD (JP) 2017-11-15 EP disclosed
CN-101516829-B Method for producing high-purity quaternary ammonium salt OTSUKA CHEMICAL CO LTD 2013-01-16 CN disclosed
CN-101516862-B Method for producing high-purity quaternary ammonium salt OTSUKA CHEMICAL CO.,LTD. (JP) 2012-02-01 CN disclosed
US-8029689-B2 Method for producing high-purity quaternary ammonium salt OTSUKA CHEMICAL CO., LTD. (JP) 2011-10-04 US disclosed
US-8029690-B2 Process for production of highly pure quaternary ammonium salt OTSUKA CHEMICAL CO., LTD. (JP) 2011-10-04 US disclosed
US-20100044617-A1 Method for producing high-purity quaternary ammonium salt STELLA CHEMIFA CORPORATION (JP) 2010-02-25 US disclosed
US-20090272933-A1 Process for production of highly pure quaternary ammonium salt STELLA CHEMIFA CORPORATION (JP) 2009-11-05 US disclosed
EP-2098518-A1 PROCESS FOR PRODUCTION OF HIGHLY PURE QUATERNARY AMMONIUM SALT Otsuka Chemical Co., Ltd. (JP) 2009-09-09 EP disclosed
CN-101516829-A Method for producing high-purity quaternary ammonium salt OTSUKA CHEMICAL CO LTD (JP) 2009-08-26 CN disclosed
CN-101516862-A Method for producing high-purity quaternary ammonium salt OTSUKA CHEMICAL CO LTD (JP) 2009-08-26 CN disclosed
EP-2072496-A1 METHOD FOR PRODUCING HIGH-PURITY QUATERNARY AMMONIUM SALT Otsuka Chemical Co., Ltd. (JP) 2009-06-24 EP disclosed