SCHEMBL24704162

SCHEMBL24704162

N#C/C=C(/c1ccccc1)c1cccc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 3/20 0.46
PDE4B Q07343 3/20 0.46
PDE4C Q08493 3/20 0.46
PDE4D Q08499 3/20 0.46
NR4A1 P22736 1/20 0.46
NR4A2 P43354 1/20 0.46
NR4A3 Q92570 1/20 0.46
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
HSP90AA1 P07900 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
CDC25B P30305 1/20 0.41
TBXAS1 P24557 1/20 0.40
MMP3 P08254 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
PTPN1 P18031 1/20 0.38
PLK1 P53350 1/20 0.38
PTK2B Q14289 1/20 0.37

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
SCHEMBL24704152 1.00 PDE4A (0.46) PDE4APDE4BPDE4CPDE4DNR4A1
SCHEMBL24704158 0.90 NR4A1 (0.47) NR4A1NR4A2NR4A3ALDH1A1HPGD
SCHEMBL10773921 0.82 CNR2 (0.45) PDE4APDE4BPDE4CPDE4DHPGD
SCHEMBL10773918 0.82 CNR2 (0.45) PDE4APDE4BPDE4CPDE4DHPGD
SCHEMBL10848465 0.80 PDE4A (0.44) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL10848469 0.80 PDE4A (0.44) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL9806349 0.79 NR4A1 (0.52) NR4A1NR4A2NR4A3ALDH1A1HPGD
SCHEMBL9806354 0.79 NR4A1 (0.52) NR4A1NR4A2NR4A3ALDH1A1HPGD
SCHEMBL4818718 0.78 PDE4A (0.66) PDE4APDE4BPDE4CPDE4D
SCHEMBL4818722 0.78 PDE4A (0.66) PDE4APDE4BPDE4CPDE4D

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-2022255228-A1 COMPOSITION, CURED PRODUCT OR COMPACT, OPTICAL MEMBER, AND LENS 富士フイルム株式会社 2022-12-08 WO disclosed