SCHEMBL4732708

SCHEMBL4732708

CCCCCS(=O)(=O)CCCCCCCCC(N)=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.57
SOAT1 P35610 2/20 0.57
MEN1 O00255 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
CA2 P00918 1/20 0.55
KDM4E B2RXH2 2/20 0.52
CES2 O00748 5/20 0.50
CES1 P23141 4/20 0.50
ESR1 P03372 2/20 0.47
ESR2 Q92731 1/20 0.47
PPARG P37231 4/20 0.46
PPARD Q03181 4/20 0.46
PPARA Q07869 4/20 0.46
TSHR P16473 3/20 0.46
GPR84 Q9NQS5 3/20 0.46
HDAC11 Q96DB2 3/20 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
SCHEMBL4732397 1.00 FAAH (0.57) FAAHSOAT1MEN1KMT2ATP53
SCHEMBL14166661 1.00 FAAH (0.57) FAAHSOAT1MEN1KMT2ATP53
SCHEMBL4731981 1.00 FAAH (0.57) FAAHSOAT1MEN1KMT2ATP53
SCHEMBL6637023 0.96 CA2 (0.55) FAAHSOAT1MEN1KMT2ATP53
SCHEMBL8759772 0.96 CA2 (0.55) FAAHSOAT1MEN1KMT2ATP53
SCHEMBL27396124 0.94 CA2 (0.53) FAAHSOAT1MEN1KMT2ATP53
SCHEMBL4302839 0.94 CA2 (0.53) FAAHSOAT1MEN1KMT2ATP53
SCHEMBL27371331 0.94 CA2 (0.53) FAAHSOAT1MEN1KMT2ATP53
SCHEMBL3164396 0.94 CA2 (0.53) FAAHSOAT1MEN1KMT2ATP53
SCHEMBL4602871 0.92 CA2 (0.50) FAAHSOAT1MEN1KMT2ATP53

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-2008044033-A1 AMIDE DERIVATIVES ASTRAZENECA AB (SE) 2008-04-17 WO disclosed