SCHEMBL346630

SCHEMBL346630

CC(=O)C(Cc1cccc(CC(C(C)=O)C(C)=O)c1)C(C)=O

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 5/20 0.46
MDM2 Q00987 1/20 0.44
NOS3 P29474 2/20 0.44
NOS1 P29475 2/20 0.44
NOS2 P35228 2/20 0.44
PNMT P11086 1/20 0.42
LDHA P00338 1/20 0.42
GRIA2 P42262 1/20 0.41
ALDH1A1 P00352 1/20 0.41
ALPI P09923 1/20 0.41
PKM P14618 1/20 0.41
PTGS1 P23219 1/20 0.41
XIAP P98170 1/20 0.41

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
SCHEMBL6692662 0.88 GRIA2 (0.51) GRIA2ALDH1A1PKM
SCHEMBL4725412 0.88 MDM2 (0.50) MDM2ALDH1A1
SCHEMBL4781067 0.88 PNMT (0.59) MDM2PNMT
SCHEMBL15505046 0.87 MAOB (0.48)
SCHEMBL6689230 0.87 SLC1A1 (0.54) MDM2
SCHEMBL1896075 0.84 MDM2 (0.61) SLC7A5MDM2ALPIPKMPTGS1
SCHEMBL4725563 0.84 TAAR1 (0.60) MDM2ALDH1A1
SCHEMBL13431365 0.84 GRIA2 (0.51) MDM2GRIA2ALDH1A1
SCHEMBL27762682 0.83 MDM2 (0.59) SLC7A5MDM2ALPIPKMPTGS1
SCHEMBL15454767 0.83 MDM2 (0.59) SLC7A5MDM2ALPIPKMPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120016147-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-19 US disclosed
US-8048982-B2 Method for producing aromatic compound polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-01 US disclosed
EP-2241547-A1 Method for producing aromatic compound polymer Sumitomo Chemical Company, Limited (JP) 2010-10-20 EP disclosed
EP-2241548-A1 Vanadium di-nuclear complex Sumitomo Chemical Company, Limited (JP) 2010-10-20 EP disclosed
US-20090018309-A1 Method for Producing Aromatic Compound Polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-15 US disclosed
EP-1767560-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER Sumitomo Chemical Company, Limited (JP) 2007-03-28 EP 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-20090018309-A1 Method for Producing Aromatic Compound Polymer PAH, MAOA, AHR SLC7A5 4495/4885MDM2 2163/4885NOS3 930/4885
US-20120016147-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER PAH, MAOA, AHR SLC7A5 4499/4885MDM2 2037/4885NOS3 962/4885

“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.