SCHEMBL23912683

SCHEMBL23912683

COCCOCC(=O)N1CCC=CCC1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 8/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
ALDH1A1 P00352 4/20 0.36
EPHX2 P34913 2/20 0.36
TLR9 Q9NR96 1/20 0.36
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
CYP1A2 P05177 1/20 0.35
POLB P06746 1/20 0.35
FKBP1A P62942 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL1292809 0.90 NAMPT (0.44) NAMPTL3MBTL1ALDH1A1EPHX2TLR9
SCHEMBL19541464 0.84 L3MBTL1 (0.46) NAMPTL3MBTL1ALDH1A1POLB
SCHEMBL15934102 0.81 GAA (0.46) NAMPTL3MBTL1CYP1A2POLBMAPT
SCHEMBL14654219 0.79 L3MBTL1 (0.70) L3MBTL1ALDH1A1POLBFKBP1A
SCHEMBL12706442 0.79 L3MBTL1 (0.42) NAMPTL3MBTL1ALDH1A1EPHX2TLR9
SCHEMBL16826963 0.78 TPSAB1 (0.44) NAMPTL3MBTL1ALDH1A1EPHX2TLR9
SCHEMBL15932285 0.77 NAMPT (0.40) NAMPTL3MBTL1ALDH1A1EPHX2TLR9
SCHEMBL16826909 0.76 NAMPT (0.46) NAMPTL3MBTL1ALDH1A1EPHX2TLR9
SCHEMBL16826752 0.74 USP2 (0.45) NAMPTALDH1A1EPHX2POLBMEN1
SCHEMBL18590382 0.74 USP2 (0.45) NAMPTALDH1A1EPHX2POLBMEN1

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
EP-3689875-B1 USE OF TRIAZOLOPYRIMIDINE, TRIAZOLOPYRIDINE COMPOUNDS AND COMPOSITION THEREOF FOR TREATING PRC2-MEDIATED DISEASES SHANGHAI INST MATERIA MEDICA CAS (CN) 2021-10-13 EP disclosed