SCHEMBL29957633

SCHEMBL29957633

O=Cc1c[nH]c2c(F)c(O)ccc12

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 2/20 0.47
TRIM33 Q9UPN9 2/20 0.47
PIM3 Q86V86 10/20 0.46
PIM1 P11309 8/20 0.46
PIM2 Q9P1W9 2/20 0.46
CYP2A6 P11509 2/20 0.41
IMPDH2 P12268 1/20 0.41
PLG P00747 1/20 0.39
PLAU P00749 1/20 0.39
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL2539628 0.82 TRIM24 (0.50) TRIM24TRIM33PIM3PIM1PIM2
SCHEMBL29951142 0.82 TRIM24 (0.50) TRIM24TRIM33PIM3PIM1PIM2
SCHEMBL29954723 0.79 PIM3 (0.51) TRIM24TRIM33PIM3PIM1PIM2
SCHEMBL29952798 0.79 PIM3 (0.50) TRIM24TRIM33PIM3PIM1PIM2
SCHEMBL2534041 0.79 TRIM24 (0.47) TRIM24TRIM33PIM3PIM1PIM2
SCHEMBL29951655 0.79 TRIM24 (0.47) TRIM24TRIM33PIM3PIM1PIM2
SCHEMBL29956475 0.79 PIM3 (0.55) TRIM24TRIM33PIM3PIM1PIM2
SCHEMBL29955047 0.79 ERN1 (0.50) TRIM24TRIM33PIM3PIM1PIM2
SCHEMBL14519078 0.79 PIM3 (0.65) TRIM24TRIM33PIM3PIM1PIM2
SCHEMBL29955386 0.77 TRIM24 (0.66) 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