SCHEMBL27680313

SCHEMBL27680313

O=C1c2cccc(F)c2C(=O)c2c(O)ccc(O)c21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.61
MEN1 O00255 8/20 0.61
KMT2A Q03164 8/20 0.61
MAOA P21397 6/20 0.61
HPGD P15428 7/20 0.59
TDP1 Q9NUW8 7/20 0.59
ALDH1A1 P00352 7/20 0.59
MAPK1 P28482 7/20 0.59
ALOX15 P16050 5/20 0.59
HSD17B10 Q99714 5/20 0.59
SMN1; SMN2 Q16637 5/20 0.59
TSHR P16473 3/20 0.59
MAOB P27338 2/20 0.59
LMNA P02545 2/20 0.59
HTT P42858 1/20 0.59
EGFR P00533 1/20 0.57
PIM1 P11309 1/20 0.57
CSNK2A2 P19784 3/20 0.57
CSNK2B P67870 3/20 0.57
CSNK2A1 P68400 3/20 0.57

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
SCHEMBL27660273 0.89 MAPT (0.77) MAPTMEN1KMT2AMAOAHPGD
SCHEMBL10716838 0.85 MAOA (0.52) MAPTMEN1KMT2AMAOAHPGD
SCHEMBL3897351 0.85 MAOA (0.73) MAPTMEN1KMT2AMAOAHPGD
SCHEMBL3198327 0.84 MAOA (0.86) MAPTMEN1KMT2AMAOAHPGD
SCHEMBL30695844 0.84 MAOA (0.86) MAPTMEN1KMT2AMAOAHPGD
SCHEMBL8916299 0.83 MAPT (0.54) MAPTMEN1KMT2AMAOAHPGD
SCHEMBL11863082 0.82 MAPT (0.76) MAPTMEN1KMT2AMAOAHPGD
SCHEMBL5866470 0.81 CA1 (0.52) MAPTMEN1KMT2AMAOAHPGD
SCHEMBL760904 0.79 ADORA2A (0.57) MAPTMEN1KMT2AMAOAHPGD
SCHEMBL3896954 0.79 CSNK2A2 (0.54) MAPTMEN1KMT2AMAOAHPGD

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-1934079-A Anthraquinone compounds as anti cancer compounds SOMANTA LTD (GB) 2007-03-21 CN disclosed