SCHEMBL23794890

SCHEMBL23794890

Oc1ccccc1Nc1ccon1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.46
POLB P06746 3/20 0.46
MAPK8 P45983 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
CXCR2 P25025 2/20 0.39
LMNA P02545 2/20 0.38
HPGD P15428 2/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
PIM1 P11309 1/20 0.37
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
NPC1 O15118 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
TLR9 Q9NR96 1/20 0.36
ABCB1 P08183 1/20 0.36

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
SCHEMBL29463913 0.78 MAPK10 (0.53) GAASMN1; SMN2MEN1KMT2ALMNA
SCHEMBL19477810 0.78 MAPK10 (0.53) GAASMN1; SMN2MEN1KMT2ALMNA
SCHEMBL23794886 0.74 MAPT (0.62) GAAPOLBSMN1; SMN2MEN1KMT2A
SCHEMBL5765529 0.72 KMT2A (0.50) GAASMN1; SMN2MEN1KMT2AL3MBTL1
SCHEMBL304891 0.72 CXCR2 (0.54) GAAPOLBSMN1; SMN2MEN1KMT2A
SCHEMBL22529449 0.71 MAPK1 (0.54) GAAPOLBSMN1; SMN2MEN1KMT2A
SCHEMBL29463935 0.71 MAPK1 (0.54) GAAPOLBSMN1; SMN2MEN1KMT2A
SCHEMBL1920752 0.70 CXCR2 (0.52) GAAPOLBSMN1; SMN2MEN1KMT2A
SCHEMBL2485883 0.69 KMT2A (0.73) GAAPOLBMAPK8SMN1; SMN2MEN1
SCHEMBL23794894 0.69 AURKA (0.49) GAAPOLBSMN1; SMN2MEN1KMT2A

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-3876933-A1 NEUTROPHIL INFLAMMATION INHIBITOR AND USES THEREOF Chang Gung University of Science and Technology (TW) 2021-09-15 EP disclosed