SCHEMBL29329019

SCHEMBL29329019

CCc1cc(C(=O)OCc2ccccc2)cc(COC)n1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.53
TDP1 Q9NUW8 4/20 0.53
SLC6A2 P23975 1/20 0.53
SLC6A3 Q01959 1/20 0.53
LMNA P02545 4/20 0.50
ALDH1A1 P00352 6/20 0.47
MAPT P10636 4/20 0.47
HPGD P15428 2/20 0.47
RAB9A P51151 4/20 0.46
GAA P10253 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.44
NPC1 O15118 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
KDM4E B2RXH2 1/20 0.43
JMJD6 Q6NYC1 1/20 0.43
CYP3A4 P08684 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL19975594 0.85 KMT2A (0.50) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL24993710 0.80 TDP1 (0.62) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL29329010 0.80 TDP1 (0.43) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL25187553 0.78 TDP1 (0.51) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL19975598 0.77 KMT2A (0.45) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL24359759 0.76 TDP1 (0.45) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL6282770 0.76 KMT2A (0.81) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL25713483 0.76 TDP1 (0.64) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL20830625 0.75 TDP1 (0.67) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL13469247 0.74 TDP1 (0.71) KMT2ATDP1SLC6A2SLC6A3LMNA

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-12043833-B2 Targeted compositions ARBUTUS BIOPHARMA CORPORATION (CA) 2024-07-23 US disclosed