SCHEMBL2470745

SCHEMBL2470745

CCN(CC)CCCC[C]=O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.36
NPSR1 Q6W5P4 1/20 0.34
PAOX Q6QHF9 1/20 0.33
ALDH1A1 P00352 2/20 0.32
HRH4 Q9H3N8 2/20 0.32
HRH3 Q9Y5N1 2/20 0.32
SLC6A4 P31645 2/20 0.32
SLC6A2 P23975 1/20 0.32
HRH1 P35367 1/20 0.32
SLC2A1 P11166 1/20 0.31
KCNH2 Q12809 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
SCHEMBL11622085 0.98 PAOX (0.36) SIGMAR1NPSR1PAOXALDH1A1HRH4
SCHEMBL7379222 0.98 PAOX (0.36) SIGMAR1NPSR1PAOXALDH1A1HRH4
SCHEMBL2471432 0.92 NPSR1 (0.35) SIGMAR1NPSR1PAOXALDH1A1SLC6A4
SCHEMBL7672922 0.85 DRD2 (0.33)
SCHEMBL10774776 0.85 KDM4E (0.33) SIGMAR1ALDH1A1
SCHEMBL7674511 0.83 KDM5A (0.39) NPSR1
SCHEMBL1033692 0.81
SCHEMBL10771066 0.78 KDM5A (0.39)
SCHEMBL9431917 0.78 DNM1 (0.39) KCNH2
SCHEMBL10769544 0.78 KDM4E (0.34) SIGMAR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6380197-B1 FOR TREATING AND PREVENTING A PLETHORA OF DISEASES INCLUDING DIABETES AVENTIS PHARMA S. A. (FR) 2002-04-30 US claimed
EP-1001943-A1 POLYHYDROXYALKYLPYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM Aventis Pharma S.A. (FR) 2000-05-24 EP claimed
WO-1999003843-A1 POLYHYDROXYALKYLPYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM RHONE-POULENC RORER S.A. (FR) 1999-01-28 WO claimed
CN-109562153-A mRNA mediated immunization methods 诺华股份有限公司 2019-04-02 CN disclosed
EP-2370406-A1 HIGH PENETRATION COMPOSITIONS AND THEIR APPLICATIONS Yu, Chongxi (US) 2011-10-05 EP disclosed
WO-2010065936-A1 HIGH PENETRATION COMPOSITIONS AND THEIR APPLICATIONS YU CHONGXI (US) 2010-06-10 WO disclosed
US-6380197-B1 FOR TREATING AND PREVENTING A PLETHORA OF DISEASES INCLUDING DIABETES AVENTIS PHARMA S. A. (FR) 2002-04-30 US disclosed
US-5358949-A Carbostyril derivatives and salts thereof and anti-arrhythmic agents containing the carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-10-25 US disclosed
EP-0236140-A2 Carbostyril derivatives and salts thereof and anti-arrhythmic agents containing the carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1987-09-09 EP disclosed