SCHEMBL28346563

SCHEMBL28346563

O=C1NOC=C(O)C1c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.41
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPK1 P28482 1/20 0.38
HTR2B P41595 1/20 0.38
KDM4E B2RXH2 2/20 0.38
POLB P06746 1/20 0.38
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
SIRT1 Q96EB6 4/20 0.34
ABL1 P00519 1/20 0.34
RIN1 Q13671 1/20 0.34
DDB1 Q16531 1/20 0.32
CRBN Q96SW2 1/20 0.32
RAB9A P51151 1/20 0.32
SLC6A3 Q01959 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL2644762 0.72 MAPT (0.42) MAPTLMNATP53CYP1A2CYP3A4
SCHEMBL27532467 0.72 MAPT (0.42) CA2MAPTLMNATP53CYP1A2
SCHEMBL5666189 0.66 LMNA (0.39) CA2MAPTLMNATP53CYP1A2
SCHEMBL30262472 0.66 LMNA (0.39) CA2MAPTLMNATP53CYP1A2
SCHEMBL9816846 0.66 LMNA (0.39) CA2MAPTLMNATP53CYP1A2
SCHEMBL7883065 0.65 MAPT (0.52) CA2MAPTLMNATP53CYP1A2
SCHEMBL30608092 0.64 CA2 (0.40) CA2MAPTLMNATP53CYP1A2
SCHEMBL623143 0.63 MAPT (0.41) CA2MAPTLMNATP53CYP1A2
SCHEMBL1639992 0.62 MAPT (0.48) CA2MAPTLMNATP53CYP1A2
SCHEMBL10707636 0.61 MAPT (0.52) CA2MAPTLMNATP53CYP1A2

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
CN-110546273-A quantification of NGS DNA by adaptor sequences LIFE TECHNOLOGIES CORP 2019-12-06 CN disclosed