SCHEMBL9879335

SCHEMBL9879335

CCCCCCCCN(CCCCCCCC)C(=O)N=NC(N)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.41
CA1 P00915 3/20 0.41
CA9 Q16790 3/20 0.41
CA2 P00918 1/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ZDHHC20 Q5W0Z9 2/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
MGLL Q99685 1/20 0.38
CYP3A4 P08684 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
EHMT2 Q96KQ7 1/20 0.37
HSD17B10 Q99714 1/20 0.37
EHMT1 Q9H9B1 1/20 0.37
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MMP8 P22894 1/20 0.36
DNM1 Q05193 3/20 0.35

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
SCHEMBL9878407 1.00 CA12 (0.41) CA12CA1CA9CA2MEN1
SCHEMBL9878936 0.92 CA1 (0.45) CA12CA1CA9CA2MEN1
SCHEMBL11650184 0.84 ALDH1A1 (0.43) CA12CA1CA9CA2CYP3A4
SCHEMBL25270460 0.76 CA12 (0.50) CA12CA1CA9CA2MEN1
SCHEMBL25271587 0.76 CA12 (0.50) CA12CA1CA9CA2MEN1
SCHEMBL25277862 0.76 CA12 (0.50) CA12CA1CA9CA2MEN1
SCHEMBL25223124 0.76 CA12 (0.50) CA12CA1CA9CA2MEN1
SCHEMBL25277072 0.76 CA12 (0.50) CA12CA1CA9CA2MEN1
SCHEMBL25277613 0.76 CA12 (0.50) CA12CA1CA9CA2MEN1
SCHEMBL25224498 0.76 CA12 (0.50) CA12CA1CA9CA2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3129449-B1 DIESEL FUEL WITH IMPROVED IGNITION CHARACTERISTICS SHELL INT RESEARCH (NL) 2018-03-28 EP disclosed
US-9862905-B2 Diesel fuel with improved ignition characteristics SHELL OIL COMPANY (US) 2018-01-09 US disclosed
EP-2958977-B1 DIESEL FUEL WITH IMPROVED IGNITION CHARACTERISTICS SHELL INT RESEARCH (NL) 2017-10-04 EP disclosed
EP-3129449-A1 DIESEL FUEL WITH IMPROVED IGNITION CHARACTERISTICS Shell Internationale Research Maatschappij B.V. (NL) 2017-02-15 EP disclosed
US-9447356-B2 Diesel fuel with improved ignition characteristics SHELL OIL COMPANY (US) 2016-09-20 US disclosed
EP-2958977-A1 DIESEL FUEL WITH IMPROVED IGNITION CHARACTERISTICS Shell Internationale Research Maatschappij B.V. (NL) 2015-12-30 EP disclosed
WO-2015157207-A1 DIESEL FUEL WITH IMPROVED IGNITION CHARACTERISTICS SHELL OIL COMPANY (US) 2015-10-15 WO disclosed
US-20150284652-A1 DIESEL FUEL WITH IMPROVED IGNITION CHARACTERISTICS SHELL OIL COMPANY 2015-10-08 US disclosed
WO-2014130439-A1 DIESEL FUEL WITH IMPROVED IGNITION CHARACTERISTICS SHELL OIL COMPANY (US) 2014-08-28 WO disclosed
US-20140230320-A1 DIESEL FUEL WITH IMPROVED IGNITION CHARACTERISTICS SHELL OIL COMPANY (US) 2014-08-21 US disclosed
US-5055545-A Paint primers; bonding strength; tire sidewalls; decoration BRIDGESTONE/FIRESTONE, INC. (US) 1991-10-08 US disclosed
US-4104301-A BLOWING AGENTS ARMSTRONG CORK COMPANY (US) 1978-08-01 US disclosed