SCHEMBL8034091

SCHEMBL8034091

O=C(O)c1ccc(C(=O)OCCOCCOCCOC(=O)c2ccc(C(=O)OC(=O)c3cccc(C(=O)O)c3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.51
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
SERPINE1 P05121 2/20 0.44
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
KMT2A Q03164 2/20 0.40
HPGD P15428 1/20 0.40
MAPT P10636 1/20 0.40
MEN1 O00255 1/20 0.40
SLC7A5 Q01650 1/20 0.39
MAPK1 P28482 1/20 0.39
HIF1A Q16665 1/20 0.39

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
SCHEMBL2204656 0.91 TDP1 (0.61) TDP1LMNASERPINE1ESR1ESR2
SCHEMBL5968457 0.87 SLC7A5 (0.52) TDP1LMNASMN1; SMN2SERPINE1ESR1
SCHEMBL27527167 0.86 TSHR (0.50) TDP1LMNAKMT2AHPGDMEN1
SCHEMBL9421257 0.86 TDP1 (0.62) TDP1LMNASERPINE1KMT2ASLC7A5
SCHEMBL731019 0.85 TDP1 (0.50) TDP1LMNASMN1; SMN2SERPINE1KMT2A
Triethylene Glycol SCHEMBL11781871 0.85 TDP1 (0.50) TDP1LMNASMN1; SMN2SERPINE1KMT2A
SCHEMBL27574211 0.84 TDP1 (0.60) TDP1LMNASMN1; SMN2SERPINE1KMT2A
SCHEMBL9276196 0.84 TDP1 (0.53) TDP1LMNASMN1; SMN2SERPINE1ESR1
SCHEMBL4632174 0.84 CA12 (0.52) TDP1LMNAKMT2AHPGDMEN1
SCHEMBL1138393 0.84 TSHR (0.52) TDP1LMNAKMT2AHPGDMEN1

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-0983868-A1 Heat-sensitive stencil sheet RISO KAGAKU CORPORATION (JP) 2000-03-08 EP disclosed