SCHEMBL29952905

SCHEMBL29952905

N#CCNC(=O)CC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 4/20 0.43
CTSS P25774 11/20 0.40
CTSL P07711 4/20 0.40
LDHA P00338 1/20 0.38
SRR Q9GZT4 1/20 0.38
CTSB P07858 3/20 0.37
CTSK P43235 8/20 0.36

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
SCHEMBL6866925 0.81 PHF8 (0.46) MCL1CTSSCTSL
SCHEMBL11633878 0.80 MCL1 (0.43) MCL1CTSSCTSLCTSBCTSK
SCHEMBL10631585 0.79 MCL1 (0.46) MCL1CTSSCTSLCTSBCTSK
SCHEMBL5418544 0.77
SCHEMBL5154225 0.77
SCHEMBL7747430 0.77 LDHA (0.40) MCL1LDHASRR
SCHEMBL12472218 0.76 MCL1 (0.40) MCL1CTSSCTSLCTSBCTSK
SCHEMBL1934297 0.76
SCHEMBL7823923 0.75
SCHEMBL13504784 0.75

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