SCHEMBL7029449

SCHEMBL7029449

CCN(CCO)c1ccccc1C=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
PABPC1 P11940 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
LMNA P02545 2/20 0.39
THRB P10828 1/20 0.39
BLM P54132 1/20 0.39
ALDH1A3 P47895 2/20 0.38
ALDH1A1 P00352 8/20 0.38
ALDH3A1 P30838 2/20 0.38
TSHR P16473 1/20 0.37
TRIM24 O15164 1/20 0.37
TRIM33 Q9UPN9 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
HTT P42858 2/20 0.34
HPGD P15428 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MAPT P10636 3/20 0.33
SLC29A1 Q99808 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL29354732 0.88 KMT2A (0.50) MEN1KMT2ATDP1LMNATHRB
SCHEMBL465195 0.88 KMT2A (0.50) MEN1KMT2ATDP1LMNATHRB
SCHEMBL8712642 0.83 MEN1 (0.39) MEN1KMT2ATDP1LMNATHRB
SCHEMBL14521051 0.81 MEN1 (0.43) MEN1KMT2APABPC1TDP1LMNA
Biphenyl SCHEMBL61055 0.81 MEN1 (0.43) MEN1KMT2ATDP1LMNATHRB
SCHEMBL8355276 0.81 ALDH1A1 (0.46) MEN1KMT2APABPC1TDP1LMNA
SCHEMBL4091793 0.79 ALDH1A1 (0.47) MEN1KMT2ATDP1LMNATHRB
SCHEMBL30200292 0.77 MEN1 (0.42) MEN1KMT2APABPC1LMNAALDH1A1
SCHEMBL29082974 0.77 MEN1 (0.39) MEN1KMT2ATDP1LMNATHRB
SCHEMBL5859018 0.77 TSHR (0.58) KMT2ATDP1LMNAALDH1A3ALDH1A1

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-20030022105-A1 TWO -PHOTON UPCONVERTING DYES AND APPLICATIONS PRASAD PARAS N (US) 2003-01-30 US disclosed