SCHEMBL347674

SCHEMBL347674

O=[N+]([O-])c1ccc(COc2cccc3ccccc23)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.65
KMT2A Q03164 4/20 0.65
NPC1 O15118 3/20 0.65
PTGES O14684 2/20 0.60
MAPT P10636 8/20 0.58
NPSR1 Q6W5P4 3/20 0.58
GAA P10253 2/20 0.58
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2C19 P33261 1/20 0.58
LMNA P02545 4/20 0.56
RAB9A P51151 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
ALDH1A1 P00352 1/20 0.56
HTR1A P08908 1/20 0.53
ADRA1D P25100 1/20 0.53
ADRA1A P35348 1/20 0.53
ADRA1B P35368 1/20 0.53
ALOX5 P09917 2/20 0.52
MRGPRX4 Q96LA9 1/20 0.50

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
SCHEMBL9687632 0.86 MAPT (0.67) MEN1KMT2ANPC1MAPTNPSR1
SCHEMBL9574725 0.84 MAPT (0.67) MEN1KMT2ANPC1PTGESMAPT
SCHEMBL28013947 0.80 KCNA3 (0.66) MEN1KMT2AMAPTNPSR1GAA
SCHEMBL9566106 0.79 MAPT (0.60) MEN1KMT2ANPC1MAPTNPSR1
SCHEMBL30096056 0.79 MAPT (0.60) MEN1KMT2ANPC1MAPTNPSR1
SCHEMBL1083102 0.79 MEN1 (1.00) MEN1KMT2ANPC1MAPTNPSR1
SCHEMBL29568609 0.79 MRGPRX4 (0.67) KMT2ANPC1MAPTGAALMNA
SCHEMBL27629 0.79 MRGPRX4 (0.67) KMT2ANPC1MAPTGAALMNA
SCHEMBL25204382 0.79 MAPT (0.59) MEN1KMT2ANPC1MAPTNPSR1
SCHEMBL6031737 0.79 MAPT (0.59) MEN1KMT2ANPC1MAPTNPSR1

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-2241548-A1 Vanadium di-nuclear complex Sumitomo Chemical Company, Limited (JP) 2010-10-20 EP disclosed
EP-2241547-A1 Method for producing aromatic compound polymer 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 MEN1 4081/4885KMT2A 674/4885NPC1 3935/4885
US-20120016147-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER PAH, MAOA, AHR MEN1 4122/4885KMT2A 715/4885NPC1 3836/4885

“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.