SCHEMBL21563328

SCHEMBL21563328

CCCCCCCCCC(=O)NCCCC[C@H](C)C(C)=O

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CASP2 P42575 1/20 0.59
▸ FAAH O00519 8/20 0.57
▸ NAAA Q02083 1/20 0.56
▸ DNM1 Q05193 2/20 0.54
▸ EPHX2 P34913 3/20 0.52
▸ SLC6A5 Q9Y345 2/20 0.51
▸ MEN1 O00255 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ NOD1 Q9Y239 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
SCHEMBL12666301 0.88 CASP2 (0.59) CASP2FAAHNAAADNM1EPHX2
SCHEMBL47703 0.88 CASP2 (0.59) CASP2FAAHNAAADNM1EPHX2
SCHEMBL12391838 0.88 CASP2 (0.42) CASP2FAAHNAAADNM1EPHX2
SCHEMBL25878486 0.86 CASP2 (0.57) CASP2FAAHNAAADNM1EPHX2
SCHEMBL13120985 0.86 CASP2 (0.57) CASP2FAAHNAAADNM1EPHX2
SCHEMBL12037630 0.86 SLC6A5 (0.54) CASP2FAAHNAAASLC6A5
SCHEMBL10088131 0.86 CASP2 (0.56) CASP2FAAHNAAADNM1EPHX2
SCHEMBL23843180 0.85 CASP2 (0.65) CASP2FAAHNAAADNM1EPHX2
SCHEMBL1289184 0.85 FAAH (0.71) CASP2FAAHNAAADNM1EPHX2
SCHEMBL342717 0.85 FAAH (0.71) CASP2FAAHNAAADNM1EPHX2

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-2019217682-A1 CYCLIC CELL-PENETRATING PEPTIDES WITH ONE OR MORE HYDROPHOBIC RESIDUES OHIO STATE INNOVATION FOUNDATION (US) 2019-11-14 — — WO disclosed
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