SCHEMBL29954012

SCHEMBL29954012

Nc1cccc2c(C=O)c[nH]c12

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.64
TRIM33 Q9UPN9 1/20 0.64
PIM3 Q86V86 12/20 0.54
PIM1 P11309 10/20 0.54
PIM2 Q9P1W9 2/20 0.53
IMPDH2 P12268 2/20 0.52
CYP2A6 P11509 2/20 0.52
KMT2A Q03164 1/20 0.46
PARP1 P09874 1/20 0.41
CLK1 P49759 1/20 0.39
CDK5 Q00535 1/20 0.39
CDK5R1 Q15078 1/20 0.39

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
SCHEMBL27868506 0.84 TRIM24 (0.54) TRIM24TRIM33PIM3PIM1PIM2
SCHEMBL27884959 0.84 TRIM24 (0.54) TRIM24TRIM33PIM3PIM1PIM2
SCHEMBL29954763 0.82 TRIM24 (0.70) TRIM24TRIM33PIM3PIM1PIM2
SCHEMBL29955386 0.79 TRIM24 (0.66) TRIM24TRIM33PIM3PIM1PIM2
SCHEMBL670824 0.78 TRIM24 (0.64) TRIM24TRIM33PIM3PIM1PIM2
SCHEMBL1092989 0.78 TRIM24 (0.64) TRIM24TRIM33PIM3PIM1PIM2
SCHEMBL672635 0.78 TRIM24 (1.00) TRIM24TRIM33PIM3PIM1PIM2
SCHEMBL16067373 0.78 PIM3 (0.77) TRIM24TRIM33PIM3PIM1PIM2
SCHEMBL29953184 0.78 PIM3 (0.77) TRIM24TRIM33PIM3PIM1PIM2
SCHEMBL14519078 0.78 PIM3 (0.65) TRIM24TRIM33PIM3PIM1PIM2

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