SCHEMBL10011045

SCHEMBL10011045

O=C(Nc1ccc(O)cc1O)c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNMA1 Q12791 2/20 0.57
HDAC1 Q13547 2/20 0.57
HDAC2 Q92769 2/20 0.57
CXCR1 P25024 1/20 0.55
TP53 P04637 2/20 0.55
MAPT P10636 4/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
TDP1 Q9NUW8 3/20 0.54
PKM P14618 1/20 0.54
GRIK1 P39086 1/20 0.54
ALDH1A1 P00352 2/20 0.54
LTC4S Q16873 1/20 0.54
HTT P42858 1/20 0.54
ABL1 P00519 1/20 0.54
TSHR P16473 1/20 0.54
RIN1 Q13671 1/20 0.54
GAA P10253 1/20 0.53
TYR P14679 1/20 0.52
TOP1 P11387 1/20 0.51

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
SCHEMBL12431978 0.89 MEN1 (0.59) KCNMA1CXCR1TP53MAPTMEN1
SCHEMBL2380752 0.86 HDAC1 (0.71) KCNMA1HDAC1HDAC2TP53MAPT
SCHEMBL22905311 0.86 HDAC1 (0.71) KCNMA1HDAC1HDAC2MAPTMEN1
SCHEMBL3017155 0.85 HDAC1 (0.57) KCNMA1HDAC1HDAC2TP53MAPT
SCHEMBL5178629 0.85 HDAC1 (0.69) KCNMA1HDAC1HDAC2TP53MAPT
SCHEMBL14740985 0.84 HCAR3 (0.61) KCNMA1HDAC1HDAC2TP53MAPT
SCHEMBL6096421 0.84 MEN1 (0.74) MAPTMEN1KMT2ATDP1PKM
SCHEMBL30799070 0.84 HDAC1 (0.55) KCNMA1HDAC1HDAC2TP53MAPT
SCHEMBL27383786 0.84 HDAC1 (0.55) KCNMA1HDAC1HDAC2TP53MAPT
SCHEMBL12510751 0.83 HDAC1 (0.67) KCNMA1HDAC1HDAC2TP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2479203-A1 AROMATIC POLYESTER Muroran Institute of Technology (JP) 2012-07-25 EP disclosed
US-20120172570-A1 AROMATIC POLYESTER NITTA CORPORATION 2012-07-05 US disclosed