SCHEMBL13129182

SCHEMBL13129182

CCCCCCCCC(C)CCCCCC(N)=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.60
SOAT1 P35610 2/20 0.57
MEN1 O00255 2/20 0.57
FAAH O00519 2/20 0.57
KMT2A Q03164 2/20 0.57
TP53 P04637 1/20 0.57
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2C19 P33261 1/20 0.57
KDM4E B2RXH2 2/20 0.52
FFAR4 Q5NUL3 1/20 0.50
FFAR1 O14842 1/20 0.50
CES2 O00748 3/20 0.48
CES1 P23141 3/20 0.48
LMNA P02545 2/20 0.47
MAPK1 P28482 1/20 0.47
GPR84 Q9NQS5 2/20 0.46
PPARG P37231 2/20 0.46
PPARD Q03181 2/20 0.46
PPARA Q07869 2/20 0.46

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
SCHEMBL19996035 1.00 ACE2 (0.60) ACE2SOAT1MEN1FAAHKMT2A
SCHEMBL24271181 1.00 ACE2 (0.60) ACE2SOAT1MEN1FAAHKMT2A
SCHEMBL23250816 0.96 ACE2 (0.60) ACE2SOAT1MEN1FAAHKMT2A
SCHEMBL11117824 0.94 ACE2 (0.58) ACE2SOAT1MEN1FAAHKMT2A
SCHEMBL26457578 0.92 ACE2 (0.50) ACE2SOAT1MEN1FAAHKMT2A
SCHEMBL2088405 0.91 ACE2 (0.47) ACE2SOAT1MEN1FAAHKMT2A
SCHEMBL29709752 0.91 ACE2 (0.47) ACE2SOAT1MEN1FAAHKMT2A
SCHEMBL2087837 0.91 ACE2 (0.47) ACE2SOAT1MEN1FAAHKMT2A
SCHEMBL2090587 0.91 ACE2 (0.47) ACE2SOAT1MEN1FAAHKMT2A
SCHEMBL2089349 0.91 ACE2 (0.47) ACE2SOAT1MEN1FAAHKMT2A

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-7820803-B2 Immobilized phosphatidic acid probe Holmes, Andrew Bruce (GB) 2010-10-26 US disclosed