SCHEMBL25572309

SCHEMBL25572309

C=CCn1c(=O)[nH]c(=O)n(CCCC)c1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.50
KDM4E B2RXH2 4/20 0.47
ALDH1A1 P00352 4/20 0.47
HTT P42858 2/20 0.47
MAPT P10636 1/20 0.44
ATM Q13315 1/20 0.44
PDE4A P27815 3/20 0.43
ADORA2A P29274 3/20 0.43
PDE4B Q07343 3/20 0.43
PDE4C Q08493 3/20 0.43
PDE4D Q08499 3/20 0.43
ADORA2B P29275 2/20 0.43
NPSR1 Q6W5P4 1/20 0.41
GAA P10253 2/20 0.41
APEX1 P27695 1/20 0.41
ADORA3 P0DMS8 1/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RGS4 P49798 1/20 0.40

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
SCHEMBL10486046 0.95 HTT (0.49) CYP3A4KDM4EALDH1A1HTTMAPT
SCHEMBL1560781 0.89 CYP3A4 (0.54) CYP3A4KDM4EALDH1A1HTTMAPT
SCHEMBL23898446 0.88 CYP3A4 (0.42) CYP3A4KDM4EALDH1A1HTTMAPT
SCHEMBL11637084 0.87 MAPT (0.53) KDM4EALDH1A1MAPTATMPDE4A
SCHEMBL12311646 0.85 CYP3A4 (0.64) CYP3A4ALDH1A1HTTMAPTPDE4A
SCHEMBL11361357 0.84 CYP3A4 (0.57) CYP3A4KDM4EALDH1A1HTTMAPT
SCHEMBL157928 0.83 CYP3A4 (0.71) CYP3A4KDM4EALDH1A1HTTPDE4A
SCHEMBL13774951 0.82 CYP3A4 (0.59) CYP3A4ALDH1A1HTTMAPTPDE4A
SCHEMBL13661089 0.82 CYP3A4 (0.58) CYP3A4KDM4EALDH1A1HTTMAPT
SCHEMBL11077876 0.81 CYP3A4 (0.68) CYP3A4KDM4EALDH1A1HTTPDE4A

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
US-20230168582-A1 COMPOSITION FOR FORMING RESIST UNDERLYING FILM NISSAN CHEMICAL CORPORATION (JP) 2023-06-01 US disclosed