SCHEMBL29957055

SCHEMBL29957055

CC1(C=O)CCC(=O)CC1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
CYP2C9 P11712 1/20 0.33
KMT2A Q03164 1/20 0.33
TRIM24 O15164 2/20 0.32
TRIM33 Q9UPN9 2/20 0.32
CYP19A1 P11511 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL1666431 0.77 CYP19A1 (0.34) MEN1CYP2C9KMT2ATRIM24TRIM33
SCHEMBL169778 0.76
Formamide SCHEMBL28674330 0.72 MEN1 (0.32) MEN1CYP2C9KMT2ATRIM24TRIM33
SCHEMBL307642 0.71
SCHEMBL1426230 0.71
SCHEMBL99620 0.71
SCHEMBL16305564 0.69
SCHEMBL17258228 0.69
SCHEMBL9686278 0.69 MEN1 (0.37) MEN1CYP2C9KMT2ATRIM24TRIM33
SCHEMBL349627 0.69

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed