SCHEMBL12733768

SCHEMBL12733768

C=CC(=O)OCOc1ccc2cc(C(=O)Oc3ccc(OC(=O)c4ccc5cc(OCOC(=O)C(=C)C)ccc5c4)c(C)c3)ccc2c1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.35
MEN1 O00255 2/20 0.35
POLB P06746 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
APEX1 P27695 1/20 0.34
HTT P42858 1/20 0.34
HGFAC Q04756 1/20 0.34
THRB P10828 2/20 0.33
ESR1 P03372 2/20 0.33
GBA1 P04062 2/20 0.33
PPARD Q03181 1/20 0.32
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPK1 P28482 1/20 0.32
GSTP1 P09211 1/20 0.32
IGF2BP2 Q9Y6M1 1/20 0.31
ESR2 Q92731 1/20 0.31

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
SCHEMBL12733752 1.00 KMT2A (0.35) KMT2AMEN1POLBTDP1APEX1
SCHEMBL12733769 0.93 KMT2A (0.39) KMT2AMEN1POLBTDP1APEX1
SCHEMBL9906553 0.93 KMT2A (0.39) KMT2AMEN1TDP1HGFACTHRB
SCHEMBL12733748 0.92 POLB (0.38) KMT2AMEN1POLBTDP1APEX1
SCHEMBL12733774 0.90 MAPT (0.44) KMT2AMEN1POLBTDP1APEX1
SCHEMBL12733765 0.90 KMT2A (0.34) KMT2AMEN1POLBTDP1APEX1
SCHEMBL12242725 0.89 TDP1 (0.40) KMT2AMEN1POLBTDP1APEX1
SCHEMBL12242624 0.89 TDP1 (0.37) KMT2APOLBTDP1APEX1HTT
SCHEMBL9906500 0.88 HTT (0.47) POLBTDP1APEX1HTTTHRB
SCHEMBL12733767 0.88 NR1H4 (0.36) KMT2AMEN1POLBTDP1APEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7919009-B2 Polymerizable compounds and polymerizable compositions ADEKA CORPORATION (JP) 2011-04-05 US disclosed
US-7910021-B2 Polymerizable optical active compound and polymerizable composition containing the same ADEKA CORPORATION (JP) 2011-03-22 US disclosed
US-20100032621-A1 POLYMERIZABLE COMPOUNDS AND POLYMERIZABLE COMPOSITIONS ADEKA CORPORATION (JP) 2010-02-11 US disclosed
US-20100032620-A1 POLYMERIZABLE OPTICAL ACTIVE COMPOUND AND POLYMERIZABLE COMPOSITION CONTAINING THE SAME ADEKA CORPORATION (JP) 2010-02-11 US 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 (2 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-20100032620-A1 POLYMERIZABLE OPTICAL ACTIVE COMPOUND AND POLYMERIZABLE COMPOSITION CONTAINING THE SAME C1S, PYM1, MCCC2 KMT2A 3291/4885MEN1 360/4885POLB 2973/4885
US-20100032621-A1 POLYMERIZABLE COMPOUNDS AND POLYMERIZABLE COMPOSITIONS CHRM1, CHRM2, CCNE1 KMT2A 2784/4885MEN1 95/4885POLB 2404/4885

“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.