SCHEMBL23734827

SCHEMBL23734827

CC(=O)Oc1ccc(-c2cccc(-c3ccc(O)cc3)c2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.67
GAA P10253 1/20 0.67
GFER P55789 1/20 0.67
MAPT P10636 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
MEN1 O00255 1/20 0.59
ESR1 P03372 1/20 0.59
KMT2A Q03164 1/20 0.59
CYP3A4 P08684 1/20 0.56
ABL1 P00519 2/20 0.56
ABCB1 P08183 2/20 0.56
BCR P11274 2/20 0.56
HPGD P15428 1/20 0.55
POLB P06746 1/20 0.55
HSD17B10 Q99714 1/20 0.54
PREP P48147 3/20 0.51
HSD17B1 P14061 1/20 0.50
HSD17B2 P37059 1/20 0.50
BACE1 P56817 1/20 0.49
CELA1 Q9UNI1 1/20 0.49

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
SCHEMBL8470717 0.90 LMNA (0.67) LMNAGAAGFERMAPTTDP1
SCHEMBL8523753 0.90 CYP3A4 (0.66) LMNAGAAGFERMAPTTDP1
SCHEMBL28868218 0.89 HSD17B10 (0.62) LMNAGAAGFERMAPTTDP1
SCHEMBL6853303 0.89 HSD17B10 (0.66) LMNAGAAGFERMAPTTDP1
SCHEMBL4960001 0.87 LMNA (0.71) LMNAGAAGFERMAPTTDP1
SCHEMBL4607313 0.86 LMNA (0.71) LMNAGAAGFERMAPTTDP1
SCHEMBL9544647 0.83 HSD17B10 (0.68) LMNAGAAMAPTTDP1MEN1
4-Acetoxyphenol SCHEMBL203149 0.83 LMNA (0.67) LMNAGAAGFERMAPTMEN1
SCHEMBL13680438 0.83 LMNA (0.67) LMNAGAAGFERMAPTTDP1
SCHEMBL11043958 0.82 HSD17B10 (0.63) LMNAGAAGFERMAPTTDP1

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
EP-3580258-B1 OLIGOMERIC POLYOL COMPOSITIONS PRESIDIUM USA INC (US) 2021-08-11 EP disclosed