SCHEMBL2497623

SCHEMBL2497623

CCCCN(CCCC)COC

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA9 Q16790 2/20 0.36
MAPT P10636 1/20 0.34
DNM1 Q05193 3/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ALDH2 P05091 1/20 0.31
HTR1B P28222 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
SCHEMBL2494844 0.95 CA12 (0.33) CA12CA1CA9MAPT
SCHEMBL2499595 0.90 CA12 (0.35) CA12CA1CA9HTR1B
SCHEMBL2493465 0.82 HRH3 (0.32) CA12CA9
SCHEMBL2002515 0.82
SCHEMBL347977 0.80 CA12 (0.39) CA12CA1CA9MAPTDNM1
SCHEMBL24359433 0.77 HRH3 (0.32) CA12CA9
SCHEMBL347018 0.76 CA12 (0.34) CA12CA1CA9MAPTDNM1
SCHEMBL11508538 0.76 ALDH1A1 (0.43) CA12CA9DNM1TSHRALDH1A1
SCHEMBL1292701 0.76 HTR1B (0.41) CA12CA1CA9LMNAMEN1
SCHEMBL2497710 0.76

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-8029690-B2 Process for production of highly pure quaternary ammonium salt OTSUKA CHEMICAL CO., LTD. (JP) 2011-10-04 US disclosed
US-8029689-B2 Method for producing high-purity 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