SCHEMBL9252302

SCHEMBL9252302

CCCCCCCC(C)NC(N)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 1/20 0.50
ADH1C P00326 1/20 0.50
ADH1A P07327 1/20 0.50
ADH4 P08319 1/20 0.50
ADH7 P40394 1/20 0.50
FAAH O00519 2/20 0.46
MEN1 O00255 1/20 0.46
MAPK1 P28482 1/20 0.46
KMT2A Q03164 1/20 0.46
MLYCD O95822 1/20 0.45
ACE2 Q9BYF1 1/20 0.44
GPR84 Q9NQS5 3/20 0.44
SPHK1 Q9NYA1 1/20 0.44
FFAR1 O14842 1/20 0.44
CA1 P00915 1/20 0.44
EPHX1 P07099 2/20 0.43
ZDHHC7 Q9NXF8 1/20 0.43
TAS1R3 Q7RTX0 1/20 0.42
TAS1R1 Q7RTX1 1/20 0.42
TAS1R2 Q8TE23 1/20 0.42

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
SCHEMBL27586792 1.00 ADH1B (0.50) ADH1BADH1CADH1AADH4ADH7
SCHEMBL11681448 1.00 ADH1B (0.50) ADH1BADH1CADH1AADH4ADH7
SCHEMBL18596029 0.98 ADH1B (0.47) ADH1BADH1CADH1AADH4ADH7
SCHEMBL9683898 0.98 ADH1B (0.47) ADH1BADH1CADH1AADH4ADH7
SCHEMBL293527 0.92 TAS1R3 (0.49) ADH1BADH1CADH1AADH4ADH7
SCHEMBL9293672 0.83 FAAH (0.46) ADH1BADH1CADH1AADH4ADH7
SCHEMBL292612 0.83
Acetic Acid SCHEMBL11044644 0.82 ADH1B (0.44) ADH1BADH1CADH1AADH4ADH7
SCHEMBL24026188 0.82 PLA2G2C (0.50) FAAHMEN1MAPK1KMT2AGPR84
SCHEMBL17415660 0.82 GPR84 (0.50) FAAHMEN1MAPK1KMT2AACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5422373-A An alkoxybenzyl-alkylene-arylurea anticholesterol, antilipemic agents and enzyme inhibitors BURROUGHS WELLCOME CO. (US) 1995-06-06 US disclosed