SCHEMBL24435697

SCHEMBL24435697

COCn1c(=O)n(CCC2CO2)c(=O)n(CCC2CO2)c1=O

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.44
HBB P68871 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ADORA2B P29275 1/20 0.33
CASP3 P42574 1/20 0.32
CASP7 P55210 1/20 0.32
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL24435696 0.90 TP53 (0.41) TP53HBBSMN1; SMN2ADORA2BCASP3
SCHEMBL24435714 0.85 SMN1; SMN2 (0.38) TP53HBBSMN1; SMN2ALDH1A1
SCHEMBL8579242 0.84 TP53 (0.58) TP53HBBSMN1; SMN2ALDH1A1
SCHEMBL20990330 0.81 TP53 (0.69) TP53HBBSMN1; SMN2ADORA2BALDH1A1
SCHEMBL23466934 0.81 TP53 (0.69) TP53HBBSMN1; SMN2ADORA2BALDH1A1
SCHEMBL12047486 0.81 TP53 (0.50) TP53HBBSMN1; SMN2ADORA2BALDH1A1
SCHEMBL24435711 0.79 TP53 (0.48) TP53HBBSMN1; SMN2ADORA2BALDH1A1
SCHEMBL17153972 0.77 TP53 (0.50) TP53HBBSMN1; SMN2ALDH1A1
SCHEMBL12047487 0.77 TP53 (0.45) TP53HBBSMN1; SMN2ALDH1A1
SCHEMBL23940781 0.77 TP53 (0.75) TP53HBBSMN1; SMN2ALDH1A1

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-20220153920-A1 METHOD FOR PRODUCING POLYMER NISSAN CHEMICAL CORPORATION (JP) 2022-05-19 US disclosed