SCHEMBL29587221

SCHEMBL29587221

Cn1nc(C(=O)C2=C(O)CCCC2=O)c(=O)[nH]c1=O

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.33
ATM Q13315 1/20 0.32
KMT2A Q03164 3/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PARP1 P09874 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL15569803 0.74 POLB (0.35) SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL20720005 0.70 SMN1; SMN2 (0.41) SMN1; SMN2KMT2AMEN1LMNATP53
SCHEMBL15568776 0.70 MEN1 (0.33) KMT2AMEN1LMNA
SCHEMBL14968922 0.69 CYP2D6 (0.40) ATMKMT2ALMNAL3MBTL1
SCHEMBL15569610 0.69 ATM (0.37) SMN1; SMN2ATMKMT2AMEN1L3MBTL1
SCHEMBL20334901 0.69 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL16739374 0.69 MET (0.36) SMN1; SMN2TP53L3MBTL1
SCHEMBL15568846 0.68 SMN1; SMN2 (0.39) SMN1; SMN2KMT2AMEN1LMNATP53
SCHEMBL15570252 0.67 ALDH1A1 (0.31)
SCHEMBL15569697 0.67 GAA (0.38) SMN1; SMN2KMT2AMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022118813-A1 SOLID AGROCHEMICAL FORMULATION 住友化学株式会社 2022-06-09 WO disclosed
WO-2022118815-A1 SOLID AGRICHEMICAL PREPARATION 住友化学株式会社 2022-06-09 WO disclosed