SCHEMBL25878486

SCHEMBL25878486

CCCCCCCCCCCCCCCC(=O)NCCCCC(C)C(N)=O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CASP2 P42575 1/20 0.57
▸ FAAH O00519 7/20 0.55
▸ NAAA Q02083 1/20 0.54
▸ SLC6A5 Q9Y345 2/20 0.54
▸ DNM1 Q05193 2/20 0.53
▸ EPHX2 P34913 3/20 0.51
▸ NOD1 Q9Y239 1/20 0.49
▸ CNR1 P21554 1/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ MEN1 O00255 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ KMT2A Q03164 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
SCHEMBL13120985 1.00 CASP2 (0.57) CASP2FAAHNAAASLC6A5DNM1
SCHEMBL19438356 0.91 CASP2 (0.61) CASP2FAAHNAAASLC6A5DNM1
SCHEMBL20873621 0.91 CASP2 (0.61) CASP2FAAHNAAASLC6A5DNM1
SCHEMBL12891254 0.88 EPHX2 (0.51) CASP2FAAHSLC6A5EPHX2KDM4E
SCHEMBL25878526 0.88 NOD1 (0.63) SLC6A5EPHX2NOD1
SCHEMBL25877865 0.88 NOD1 (0.63) SLC6A5EPHX2NOD1
SCHEMBL21563328 0.86 CASP2 (0.59) CASP2FAAHNAAASLC6A5DNM1
SCHEMBL47703 0.86 CASP2 (0.59) CASP2FAAHNAAASLC6A5DNM1
SCHEMBL12666301 0.86 CASP2 (0.59) CASP2FAAHNAAASLC6A5DNM1
SCHEMBL20634894 0.85 CASP2 (0.42) CASP2FAAHNAAASLC6A5DNM1

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-2023139106-A2 LONG-ACTING GIPR ANTAGONISTS NOVO NORDISK A/S (DK) 2023-07-27 — — WO disclosed
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