SCHEMBL7145685

SCHEMBL7145685

c1ccc(C2(CC3CO3)OC2COCC2OC2(CC2CO2)c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
CHRM2 P08172 8/20 0.35
CHRM4 P08173 8/20 0.35
CHRM5 P08912 8/20 0.35
CHRM1 P11229 8/20 0.35
CHRM3 P20309 8/20 0.35
ALDH1A1 P00352 2/20 0.35
GLA P06280 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HIF1A Q16665 1/20 0.33
HTR1A P08908 1/20 0.32
ADRA1D P25100 1/20 0.32
ADRA1A P35348 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
SCHEMBL10588286 0.77 HCAR3 (0.33) TDP1MEN1KMT2AGRIN1GRIN2A
SCHEMBL28208612 0.74 TDP1 (0.44) TDP1CHRM2CHRM4CHRM5CHRM1
SCHEMBL11768781 0.72 OPRM1 (0.37) TDP1MEN1KMT2A
SCHEMBL17028664 0.69 TDP1 (0.49) TDP1ALDH1A1MEN1KMT2ATP53
Chlorobenzene SCHEMBL3159937 0.67 TDP1 (0.55) TDP1ALDH1A1GLAMEN1KMT2A
Biphenyl SCHEMBL23045578 0.66 TDP1 (0.59) TDP1ALDH1A1GLAMEN1KMT2A
Biphenyl SCHEMBL93293 0.66 TDP1 (0.59) TDP1ALDH1A1GLAMEN1KMT2A
Biphenyl SCHEMBL27996658 0.66 TDP1 (0.59) TDP1ALDH1A1GLAMEN1KMT2A
Tannin Pyrogallol SCHEMBL27708032 0.65 TDP1 (0.57) TDP1CHRM2ALDH1A1GLAMEN1
Benzyl Alcohol SCHEMBL14889734 0.65 TSHR (0.52) TDP1ALDH1A1GLAMEN1KMT2A

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
US-6632523-B1 Polyimidesiloxane made from a dianhydride, an aromatic diamine and a siloxanediamine, an epoxy resin, and a cyanate; tape SUMITOMO BAKELITE COMPANY LIMITED (JP) 2003-10-14 US disclosed
WO-2002026888-A2 LOW TEMPERATURE BONDING ADHESIVE COMPOSITION SUMITOMO BAKELITE COMPANY LIMITED (JP) 2002-04-04 WO disclosed