SCHEMBL4249682

SCHEMBL4249682

CCCCCOC(=O)c1cc(=O)c2ccc([N+](=O)[O-])cc2o1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.55
AKR1B1 P15121 3/20 0.52
MAPT P10636 1/20 0.46
CACNA1F O60840 6/20 0.46
CACNA1D Q01668 6/20 0.46
CACNA1S Q13698 6/20 0.46
CACNA1C Q13936 6/20 0.46
SLC2A1 P11166 1/20 0.45
ESR1 P03372 1/20 0.44
ALDH1A1 P00352 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL4246759 0.99 MAOB (0.54) MAOBAKR1B1MAPTCACNA1FCACNA1D
SCHEMBL4250533 0.97 MAOB (0.56) MAOBAKR1B1MAPTCACNA1FCACNA1D
SCHEMBL4253623 0.92 MAOB (0.65) MAOBAKR1B1MAPTSLC2A1ALDH1A1
SCHEMBL4250366 0.91 MAOB (0.55) MAOBAKR1B1MAPTCACNA1FCACNA1D
SCHEMBL4249323 0.90 MAOB (0.54) MAOBAKR1B1MAPTCACNA1FCACNA1D
SCHEMBL4246525 0.88 MAOB (0.56) MAOBAKR1B1MAPTCACNA1FCACNA1D
SCHEMBL4256577 0.88 AKR1B1 (0.67) MAOBAKR1B1MAPTSLC2A1ALDH1A1
SCHEMBL4251638 0.83 MAOB (0.65) MAOBAKR1B1MAPT
SCHEMBL4246734 0.83 AKR1B1 (0.52) MAOBAKR1B1MAPTSLC2A1ALDH1A1
SCHEMBL4248830 0.83 MAOB (0.60) MAOBAKR1B1MAPTSLC2A1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101497571-B Process for producing chromone compound SUMITOMO CO LTD 2012-07-04 CN disclosed
EP-2105431-A1 Process for Producing Chromone Compound Sumitomo Chemical Company, Limited (JP) 2009-09-30 EP disclosed
EP-2105432-A1 Process for Producing Chromone Compound Sumitomo Chemical Company, Limited (JP) 2009-09-30 EP disclosed
CN-101497571-A Process for producing chromone compound SUMITOMO CHEMICAL CO (JP) 2009-08-05 CN disclosed
CN-100509751-C Process for producing benzopyranone compound SUMITOMO CHEMICAL CO (JP) 2009-07-08 CN disclosed
EP-1867626-A2 Process for producing chromone compound Sumitomo Chemical Company, Limited (JP) 2007-12-19 EP disclosed
CN-1911896-A Process for producing chromone compound SUMITOMO CHEMICAL CO (JP) 2007-02-14 CN disclosed
US-20060217565-A1 Process for producing chromone compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-09-28 US disclosed
US-7094914-B2 Process for producing chromone compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-08-22 US disclosed
CN-1649824-A Process for producing benzopyranone compound SUMITOMO CHEMICAL CO (JP) 2005-08-03 CN disclosed
US-20050085664-A1 Process for producing chromone compound SUMITOMO CHEMICAL COMPANY, LMITED (JP) 2005-04-21 US disclosed
EP-1479667-A1 PROCESS FOR PRODUCING CHROMONE COMPOUND Sumitomo Chemical Company, Limited (JP) 2004-11-24 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-20050085664-A1 Process for producing chromone compound ENY2, CDY1; CDY1B, CDYL MAOB 476/4885AKR1B1 237/4885MAPT 4765/4885
US-20060217565-A1 Process for producing chromone compound ENY2, CDY1; CDY1B, CDYL MAOB 476/4885AKR1B1 237/4885MAPT 4765/4885

“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.