SCHEMBL15534730

SCHEMBL15534730

CCCCCCCCCC(C)NCC

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 1/20 0.54
ADH1C P00326 1/20 0.54
ADH1A P07327 1/20 0.54
ADH4 P08319 1/20 0.54
ADH7 P40394 1/20 0.54
OPRM1 P35372 1/20 0.44
ADRB2 P07550 6/20 0.43
SPHK1 Q9NYA1 1/20 0.41
LMNA P02545 1/20 0.41
DNM1 Q05193 2/20 0.40
TSHR P16473 1/20 0.40
THRB P10828 1/20 0.40
ACE2 Q9BYF1 1/20 0.38

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
SCHEMBL27625456 1.00 ADH1B (0.54) ADH1BADH1CADH1AADH4ADH7
SCHEMBL2310099 1.00 ADH1B (0.54) ADH1BADH1CADH1AADH4ADH7
SCHEMBL19621284 1.00 ADH1B (0.54) ADH1BADH1CADH1AADH4ADH7
SCHEMBL3146350 1.00 ADH1B (0.54) ADH1BADH1CADH1AADH4ADH7
SCHEMBL10066725 1.00 ADH1B (0.54) ADH1BADH1CADH1AADH4ADH7
SCHEMBL2360620 1.00 ADH1B (0.54) ADH1BADH1CADH1AADH4ADH7
SCHEMBL7762311 1.00 ADH1B (0.54) ADH1BADH1CADH1AADH4ADH7
SCHEMBL17104353 1.00 ADH1B (0.54) ADH1BADH1CADH1AADH4ADH7
SCHEMBL9204901 1.00 ADH1B (0.54) ADH1BADH1CADH1AADH4ADH7
SCHEMBL27938946 1.00 ADH1B (0.54) ADH1BADH1CADH1AADH4ADH7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2855642-A1 TERTIARY AMINES FOR REDUCING INJECTOR NOZZLE FOULING IN DIRECT INJECTION SPARK IGNITION ENGINES BASF SE (DE) 2015-04-08 EP disclosed
WO-2013174619-A1 TERTIARY AMINES FOR REDUCING INJECTOR NOZZLE FOULING IN DIRECT INJECTION SPARK IGNITION ENGINES BASF SE (DE) 2013-11-28 WO disclosed