SCHEMBL10380841

SCHEMBL10380841

CCCCNC(=O)CCCCCNC=O

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.61
ADH1B P00325 2/20 0.61
ADH1C P00326 2/20 0.61
ADH1A P07327 2/20 0.61
ADH7 P40394 2/20 0.61
FAAH O00519 4/20 0.59
EPHX1 P07099 1/20 0.59
ADH4 P08319 1/20 0.59
EPHX2 P34913 3/20 0.58
NAAA Q02083 1/20 0.58
SLC6A5 Q9Y345 2/20 0.56
DNM1 Q05193 2/20 0.56
CNR1 P21554 1/20 0.53

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
SCHEMBL23760291 0.86 CASP2 (0.47) CASP2ADH1BADH1CADH1AADH7
SCHEMBL18560547 0.86 EPHX2 (0.62) CASP2FAAHEPHX2SLC6A5CNR1
SCHEMBL21674058 0.86 EPHX2 (0.62) CASP2FAAHEPHX2SLC6A5CNR1
SCHEMBL23735537 0.86 KDM4E (0.57) CASP2ADH1BADH1CADH1AADH7
SCHEMBL22242831 0.85 CASP2 (0.66) CASP2ADH1BADH1CADH1AADH7
SCHEMBL22271592 0.85 FAAH (0.78) CASP2FAAHEPHX1EPHX2NAAA
SCHEMBL20922221 0.85 FAAH (0.78) CASP2FAAHEPHX1EPHX2NAAA
Hexadecanoic Acid Butylamide SCHEMBL1457151 0.85 FAAH (0.78) CASP2FAAHEPHX1EPHX2NAAA
SCHEMBL6682413 0.85 FAAH (0.78) CASP2FAAHEPHX1EPHX2NAAA
SCHEMBL13998056 0.85 FAAH (0.78) CASP2FAAHEPHX1EPHX2NAAA

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
WO-2012096800-A1 COMPOUNDS AND METHODS FOR DETECTION OF ENZYMES THAT REMOVE FORMYL, SUCCINYL, METHYL SUCCINYL OR MYRISTOYL GROUPS FROM EPSILON-AMINO LYSINE MOIETIES ENZO LIFE SCIENCES, INC. (US) 2012-07-19 WO disclosed