SCHEMBL23988668

SCHEMBL23988668

CC(=O)C[C@@H](N)CCCNC(=N)N

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.37
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPY4R P50391 10/20 0.35
NPY1R P25929 7/20 0.35
NPY2R P49146 5/20 0.35
NPY5R Q15761 5/20 0.35
DPP7 Q9UHL4 2/20 0.34
KDM4E B2RXH2 1/20 0.32
MAPK1 P28482 1/20 0.32
HIF1A Q16665 1/20 0.32
RRM1 P23921 1/20 0.32
PAOX Q6QHF9 2/20 0.32
OTC P00480 1/20 0.31

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
SCHEMBL289167 0.84 ALOX15 (0.38) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL7250717 0.84 ALOX15 (0.38) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL7250716 0.84 ALOX15 (0.38) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL23988832 0.83 DPP7 (0.36) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL23988965 0.83 NPY4R (0.36) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL14421568 0.83 NPY4R (0.37) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL13971371 0.83 ALOX15 (0.37) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL22081684 0.83 ALOX15 (0.37) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL23988667 0.81 DPP7 (0.37) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL13347956 0.80 ALOX15 (0.35) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2

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-2021221656-A1 COMPOSITIONS AND METHODS OF USE THEREOF SYNEDGEN, INC. (US) 2021-11-04 WO disclosed