SCHEMBL17624903

SCHEMBL17624903

CCCCC(=O)NCCCCOCC

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
NAAA Q02083 1/20 0.53
FAAH O00519 3/20 0.50
TSHR P16473 1/20 0.50
EPHX2 P34913 3/20 0.49
DNM1 Q05193 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
RAB9A P51151 1/20 0.47

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
SCHEMBL17624918 0.95 CASP2 (0.59) CASP2SMN1; SMN2NAAAFAAHTSHR
SCHEMBL17624739 0.95 SMN1; SMN2 (0.61) CASP2SMN1; SMN2NAAAFAAHTSHR
SCHEMBL19687365 0.93 CASP2 (0.62) CASP2SMN1; SMN2NAAAFAAHEPHX2
SCHEMBL15888712 0.89 SMN1; SMN2 (0.60) CASP2SMN1; SMN2NAAAFAAHTSHR
SCHEMBL17233451 0.87 CASP2 (0.63) CASP2SMN1; SMN2NAAAFAAHEPHX2
SCHEMBL14235690 0.86 SMN1; SMN2 (0.60) CASP2SMN1; SMN2NAAAFAAHTSHR
SCHEMBL26706549 0.86 SMN1; SMN2 (0.49) CASP2SMN1; SMN2NAAAFAAHTSHR
SCHEMBL13492963 0.85 SMN1; SMN2 (0.59) CASP2SMN1; SMN2NAAAFAAHTSHR
SCHEMBL16133369 0.85 CASP2 (0.55) CASP2SMN1; SMN2NAAAFAAHTSHR
SCHEMBL9633440 0.84 CASP2 (0.51) CASP2SMN1; SMN2NAAAFAAHEPHX2

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