SCHEMBL17624947

SCHEMBL17624947

CCNCCC(=O)NCC

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.52
MCL1 Q07820 2/20 0.48
CASP2 P42575 1/20 0.40
EPHX2 P34913 1/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.38
CYP2C19 P33261 2/20 0.38
GLA P06280 1/20 0.38
NAAA Q02083 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP1A2 P05177 1/20 0.36
TSHR P16473 1/20 0.36
KDM1A O60341 1/20 0.36
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MMP9 P14780 1/20 0.36
MMP8 P22894 1/20 0.36

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
SCHEMBL13755980 0.90 FAAH (0.52) FAAHMCL1CASP2EPHX2KMT2A
SCHEMBL10820630 0.90 FAAH (0.52) FAAHMCL1CASP2EPHX2KMT2A
SCHEMBL10820621 0.86 FAAH (0.54) FAAHMCL1CASP2EPHX2KMT2A
SCHEMBL6732754 0.86 MCL1 (0.52) FAAHMCL1CASP2KMT2AMEN1
SCHEMBL21658310 0.84 FAAH (0.47) FAAHMCL1EPHX2KMT2AMEN1
SCHEMBL8956531 0.82 HDAC3 (0.43) FAAHMCL1CASP2KMT2AMEN1
SCHEMBL20362854 0.82 CASP2 (0.39) FAAHMCL1CASP2KMT2AMEN1
SCHEMBL5909462 0.81 FAAH (0.64) FAAHMCL1CASP2KMT2AMEN1
SCHEMBL6733595 0.81 MCL1 (0.47) FAAHMCL1CASP2KMT2AMEN1
SCHEMBL10820649 0.81 FAAH (0.48) FAAHMCL1CASP2EPHX2KMT2A

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-2016044585-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-03-24 WO disclosed