SCHEMBL20051422

SCHEMBL20051422

O=CNCC(=O)Nc1ccc(CO)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
LMNA P02545 2/20 0.45
HPGD P15428 2/20 0.44
GAA P10253 2/20 0.44
POLB P06746 2/20 0.41
RECQL P46063 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
F2 P00734 1/20 0.38
PLG P00747 1/20 0.38
PLAU P00749 1/20 0.38
PLAT P00750 1/20 0.38
KLKB1 P03952 1/20 0.38
PRSS1 P07477 1/20 0.38
NPC1 O15118 1/20 0.38
NFKB1 P19838 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL19865318 0.82 KMT2A (0.42) MEN1KMT2ALMNAHPGDGAA
SCHEMBL6907438 0.82 CYP1A1 (0.53) MEN1KMT2AHPGDGAAPOLB
SCHEMBL23071786 0.81 SMN1; SMN2 (0.39) MEN1KMT2ALMNAHPGDGAA
SCHEMBL24279669 0.81 LMNA (0.43) MEN1KMT2ALMNAHPGDGAA
SCHEMBL5640251 0.81 GAA (0.56) MEN1KMT2ALMNAGAAPOLB
SCHEMBL6018151 0.80 EPHX2 (0.53) MEN1KMT2ALMNAGAAHDAC1
SCHEMBL23766042 0.79 CA1 (0.58) MEN1KMT2ALMNAHPGDGAA
SCHEMBL19703283 0.79 ALDH1A1 (0.46) MEN1KMT2ALMNAHPGDGAA
SCHEMBL22987301 0.78 LMNA (0.41) MEN1KMT2ALMNAHPGDGAA
SCHEMBL23783471 0.77 KMT2A (0.48) MEN1KMT2ALMNAHPGDGAA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023234426-A1 ANTIBODY-MULTIDRUG CONJUGATE UBE株式会社 2023-12-07 WO disclosed
WO-2022120132-A1 ANTIBODY-OLIGONUCLEOTIDE COMPLEXES AND USES THEREOF DYNE THERAPEUTICS, INC. (US) 2022-06-09 WO disclosed
WO-2018065501-A1 METHODS FOR PREPARING ANTIBODY DRUG CONJUGATES F. HOFFMANN-LA ROCHE AG (CH) 2018-04-12 WO disclosed