SCHEMBL30004036

SCHEMBL30004036

CCn1c(=O)n(CC(=O)O)c(=O)n(CC(=O)O)c1=O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 2/20 0.52
GLA P06280 1/20 0.38
KDM4E B2RXH2 3/20 0.38
ACE P12821 1/20 0.38
ADORA2B P29275 1/20 0.38
ALDH1A1 P00352 3/20 0.36
GSK3A P49840 2/20 0.35
GSK3B P49841 2/20 0.35
LMNA P02545 1/20 0.35
KMT2A Q03164 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GPR35 Q9HC97 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
SCHEMBL677187 0.87 APEX1 (0.62) APEX1GLAKDM4EACEADORA2B
SCHEMBL29251527 0.81 APEX1 (0.53) APEX1GLAKDM4EADORA2BALDH1A1
SCHEMBL22542545 0.81 APEX1 (0.52) APEX1GLAKDM4EACEADORA2B
SCHEMBL30976969 0.79 KDM4E (0.51) APEX1KDM4EADORA2BGSK3B
SCHEMBL5329443 0.78 APEX1 (0.82) APEX1GLAKDM4EALDH1A1LMNA
SCHEMBL3774169 0.77 APEX1 (0.59) APEX1KDM4EACEALDH1A1HSD17B10
SCHEMBL10329438 0.77 APEX1 (0.59) APEX1KDM4EACEALDH1A1HSD17B10
SCHEMBL20967578 0.76 APEX1 (0.52) APEX1GLAKDM4EACEADORA2B
SCHEMBL3767521 0.76 HTT (0.53) APEX1GLAKDM4EACEADORA2B
Mercaptopropionic Acid SCHEMBL6256699 0.76 APEX1 (0.42) APEX1KDM4EACEALDH1A1GSK3A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118103472-A Adhesive, laminate, and packaging material DIC株式会社 2024-05-28 CN disclosed
WO-2023085103-A1 ADHESIVE, LAMINATE, AND PACKAGING MATERIAL DIC株式会社 2023-05-19 WO disclosed
WO-2022239667-A1 METHOD FOR PRODUCING LAMINATE DIC株式会社 2022-11-17 WO disclosed
WO-2022220151-A1 TWO-PACK CURABLE ADHESIVE COMPOSITION, ANCHOR COATING MATERIAL, ADHESIVE, LAMINATE, AND PACKAGING MATERIAL DIC株式会社 2022-10-20 WO disclosed