SCHEMBL5070862

SCHEMBL5070862

O=Cc1cccc(Oc2cccc(C=O)c2C=O)c1C=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.50
KMT2A Q03164 3/20 0.50
GAA P10253 1/20 0.50
ALDH1A1 P00352 5/20 0.48
HPGD P15428 1/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ERN1 O75460 3/20 0.47
TLR2 O60603 1/20 0.47
TLR1 Q15399 1/20 0.47
TLR6 Q9Y2C9 1/20 0.47
MEN1 O00255 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
THRB P10828 1/20 0.46
BLM P54132 1/20 0.46
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
NPSR1 Q6W5P4 1/20 0.43
SRC P12931 2/20 0.42

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
SCHEMBL28886230 0.86 ALDH1A1 (0.48) LMNAKMT2AGAAALDH1A1HPGD
SCHEMBL6667873 0.86 LMNA (0.72) LMNAKMT2AGAAALDH1A1HPGD
SCHEMBL1028678 0.83 ERN1 (0.63) LMNAALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL3426313 0.81 ALDH1A1 (0.44) LMNAKMT2AGAAALDH1A1HPGD
SCHEMBL547829 0.80 KMT2A (0.61) LMNAKMT2AGAAALDH1A1HPGD
SCHEMBL31083348 0.79 ERN1 (0.46) LMNAKMT2AGAAALDH1A1HPGD
SCHEMBL4434944 0.78 LMNA (0.75) LMNAKMT2AGAAALDH1A1HPGD
SCHEMBL17884545 0.78 ALDH1A1 (0.50) LMNAKMT2AGAAALDH1A1HPGD
SCHEMBL31599172 0.76 LMNA (0.72) LMNAKMT2AGAAALDH1A1HPGD
SCHEMBL9639641 0.76 LMNA (0.72) LMNAKMT2AGAAALDH1A1HPGD

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-1883950-A1 OLIGOMERIC POLYACENE AND SEMICONDUCTOR FORMULATION Merck Patent GmbH (DE) 2008-02-06 EP disclosed
WO-2006125504-A1 OLIGOMERIC POLYACENE AND SEMICONDUCTOR FORMULATION MERCK PATENT GMBH (DE) 2006-11-30 WO disclosed