SCHEMBL16247238

SCHEMBL16247238

CCCCCCCCCCCCOC(=O)OCCC[N+](C)(C)C

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 2/20 0.58
NPSR1 Q6W5P4 1/20 0.58
DNM1 Q05193 6/20 0.52
NAAA Q02083 1/20 0.52
ACHE P22303 3/20 0.50
EPHX1 P07099 1/20 0.48
APAF1 O14727 1/20 0.48
HSP90AA1 P07900 1/20 0.48

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
SCHEMBL27753830 0.92 RAD52 (0.62) RAD52NPSR1NAAAACHEEPHX1
SCHEMBL9700730 0.92 RAD52 (0.62) RAD52NPSR1NAAAACHEEPHX1
SCHEMBL27733399 0.92 RAD52 (0.62) RAD52NPSR1NAAAACHEEPHX1
SCHEMBL9298334 0.90 RAD52 (0.59) RAD52NPSR1NAAAACHE
SCHEMBL8945377 0.88 CHRM5 (0.50) RAD52NPSR1ACHE
SCHEMBL4934658 0.85 NAAA (0.67) RAD52NPSR1NAAAACHEEPHX1
SCHEMBL1839498 0.85 NAAA (0.67) RAD52NPSR1NAAAACHEEPHX1
SCHEMBL1839798 0.85 NAAA (0.67) RAD52NPSR1NAAAACHEEPHX1
SCHEMBL1837444 0.85 NAAA (0.67) RAD52NPSR1NAAAACHEEPHX1
SCHEMBL1835519 0.85 NAAA (0.67) RAD52NPSR1NAAAACHEEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10859504-B2 Degradable cationic surfactants and use thereof in enhancing chemiluminescence SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2020-12-08 US disclosed
US-20160131588-A1 DEGRADABLE CATIONIC SURFACTANTS AND USE THEREOF IN ENHANCING CHEMILUMINESCENCE SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2016-05-12 US disclosed
US-20160131588-A1 DEGRADABLE CATIONIC SURFACTANTS AND USE THEREOF IN ENHANCING CHEMILUMINESCENCE SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2016-05-12 US disclosed
WO-2014186406-A2 DEGRADABLE CATIONIC SURFACTANTS AND USE THEREOF IN ENHANCING CHEMILUMINESCENCE SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2014-11-20 WO disclosed