SCHEMBL6039482

SCHEMBL6039482

COc1ccc(C(c2ccccc2)(c2ccc(OC)cc2)C(O)C(O)C(O)C(=O)CCC(C)=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 9/20 0.43
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
ALDH1A1 P00352 3/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
TP53 P04637 1/20 0.37
KCNH2 Q12809 1/20 0.36
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36

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
SCHEMBL2399933 0.81 KIF11 (0.41) KIF11KMT2AMEN1NPC1RAB9A
SCHEMBL6039133 0.80 KIF11 (0.46) KIF11NPC1RAB9ALMNAKCNH2
SCHEMBL9386756 0.75 KIF11 (0.44) KIF11KMT2AMEN1ALDH1A1LMNA
SCHEMBL8399786 0.75 KIF11 (0.43) KIF11KMT2AMEN1LMNAKCNH2
SCHEMBL8399656 0.72 KIF11 (0.44) KIF11KMT2ANPC1RAB9AALDH1A1
SCHEMBL8457734 0.71 KIF11 (0.54) KIF11KMT2AMEN1NPC1RAB9A
SCHEMBL8080069 0.71 KIF11 (0.51) KIF11KMT2AMEN1NPC1RAB9A
SCHEMBL27757625 0.71 KIF11 (0.52) KIF11ALDH1A1LMNAKCNH2
SCHEMBL15517407 0.70 KIF11 (0.56) KIF11KMT2AMEN1LMNAKCNH2
SCHEMBL8399775 0.70 CASR (0.48) KIF11KMT2AMEN1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060008813-A1 Compositions and methods of synthesis and use of novel nucleic acid structures ERITJA RAMON 2006-01-12 US disclosed
EP-1228243-A4 COMPOSITIONS AND METHODS OF SYNTHESIS AND USE OF NOVEL NUCLEIC ACID STRUCTURES CYGENE INC (US) 2005-07-20 EP disclosed
US-20030135040-A1 Compositions and methods of synthesis and use of novel nucleic acid structures CYGENE, INC. 2003-07-17 US disclosed
EP-1228243-A1 COMPOSITIONS AND METHODS OF SYNTHESIS AND USE OF NOVEL NUCLEIC ACID STRUCTURES Cygene, Inc. (US) 2002-08-07 EP disclosed
WO-2001032924-A1 COMPOSITIONS AND METHODS OF SYNTHESIS AND USE OF NOVEL NUCLEIC ACID STRUCTURES CYGENE, INC. (US) 2001-05-10 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030135040-A1 Compositions and methods of synthesis and use of novel nucleic acid structures ADAR, NSUN2, RNGTT KIF11 2927/4885KMT2A 384/4885MEN1 1521/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.