SCHEMBL24420741

SCHEMBL24420741

O=C(OC[C@H]1O[C@@H](N2C=CCNC2)C(OC(=O)c2ccccc2)C1OC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.56
USP2 O75604 2/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA9 Q16790 1/20 0.47
GAPDH P04406 2/20 0.44
HRAS P01112 1/20 0.42
PTPN1 P18031 2/20 0.40
MAPK1 P28482 2/20 0.39
GAA P10253 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALDH1A1 P00352 3/20 0.38
PTPN2 P17706 1/20 0.38
PTPN11 Q06124 1/20 0.38
TMPRSS2 O15393 1/20 0.37
PDE5A O76074 1/20 0.37
HMGCR P04035 1/20 0.37
CYP1A2 P05177 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
SCHEMBL23240642 0.82 POLB (0.59) POLBUSP2MEN1KMT2ACA1
SCHEMBL23215313 0.82 POLB (0.59) POLBUSP2MEN1KMT2ACA1
SCHEMBL11390386 0.78 POLB (0.59) POLBUSP2MEN1KMT2ACA1
SCHEMBL24420740 0.78 POLB (0.56) POLBUSP2MEN1KMT2ACA1
SCHEMBL23240640 0.76 POLB (0.59) POLBUSP2MEN1KMT2ACA1
SCHEMBL23215197 0.76 POLB (0.59) POLBUSP2MEN1KMT2ACA1
SCHEMBL14274476 0.76 POLB (0.61) POLBUSP2MEN1KMT2ACA1
SCHEMBL11255104 0.76 POLB (0.58) POLBUSP2MEN1KMT2ACA1
SCHEMBL11442315 0.75 USP2 (0.62) POLBUSP2MEN1KMT2ACA1
SCHEMBL22796828 0.74 POLB (0.52) POLBUSP2MEN1KMT2ACA1

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
WO-2022099159-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2022-05-12 WO disclosed