SCHEMBL4077346

SCHEMBL4077346

CCCCC(=O)Oc1ccc([N+](=O)[O-])c(O)c1[N+](=O)[O-]

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
RECQL P46063 1/20 0.44
ALDH1A1 P00352 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
BCL9 O00512 1/20 0.42
CTNNB1 P35222 1/20 0.42
ALOX15 P16050 1/20 0.40
ESR1 P03372 1/20 0.40
THRA P10827 1/20 0.38
THRB P10828 1/20 0.38
TOP2A P11388 2/20 0.38
PLA2G4B P0C869 1/20 0.38
GAA P10253 1/20 0.37
HPGD P15428 1/20 0.37
TRPV1 Q8NER1 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 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
SCHEMBL4077474 0.80 KMT2A (0.54) KMT2ASMN1; SMN2KDM4EMEN1RECQL
SCHEMBL28915591 0.78 POLM (0.51) KMT2ASMN1; SMN2KDM4EMEN1RECQL
SCHEMBL1013795 0.78 KMT2A (0.58) KMT2ASMN1; SMN2KDM4EMEN1RECQL
SCHEMBL4076676 0.76 KMT2A (0.47) KMT2ASMN1; SMN2KDM4EMEN1RECQL
SCHEMBL2538773 0.74 GAA (0.58) KMT2ASMN1; SMN2KDM4EMEN1RECQL
SCHEMBL27988647 0.74 ALDH1A1 (0.59) KMT2ASMN1; SMN2KDM4EALDH1A1TDP1
SCHEMBL28897477 0.73 KMT2A (0.42) KMT2ASMN1; SMN2KDM4EMEN1RECQL
SCHEMBL1625689 0.73 GPR35 (0.47) KMT2ASMN1; SMN2KDM4EMEN1RECQL
SCHEMBL27528354 0.73 KMT2A (0.47) KMT2ASMN1; SMN2KDM4EMEN1RECQL
SCHEMBL28423498 0.73 JMJD7 (0.54) KMT2ASMN1; SMN2KDM4EMEN1ALDH1A1

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7615233-B2 Particulate construct comprising polyhydroxyalkanoate and method for producing it CANON KABUSHIKI KAISHA (JP) 2009-11-10 US disclosed
US-7527809-B2 Polyhydroxyalkanoate-containing magnetic structure, and manufacturing method and use thereof CANON KABUSHIKI KAISHA (JP) 2009-05-05 US disclosed
EP-1113033-B1 Polyhydroxyalkanoate CANON KK (JP) 2008-11-26 EP disclosed
US-7393912-B2 Polyhydroxyalkanoate containing amide group, sulfonic group, and sulfonate ester group, method for producing the same, and charge control agent, toner, image forming method, and image forming apparatus CANON KABUSHIKI KAISHA (JP) 2008-07-01 US disclosed
US-7169598-B2 Polyhydroxyalkanoate, method for production thereof and microorganisms for use in the same CANON KABUSHIKI KAISHA (JP) 2007-01-30 US disclosed
EP-1336635-B1 Polyhydroxyalkanoate having amide group and sulfonic group, method of producing the same, charge controlling agent containing the polyhydroxyalkanoate, toner binder, toner, and image formation method and image forming apparatus using the toner CANON KK (JP) 2007-01-17 EP disclosed
US-20060263432-A1 Useful as a sustained release pharmaceutical preparation; microcapsule stably containing a drug, especially a water-soluble drug at high content and which has magnetic property; drug delivery; excellent in dispersibility and magnetic response CANON KABUSHIKI KAISHA (JP) 2006-11-23 US disclosed
EP-1579277-B1 POLYHYDROXYALKANOATE CONTAINING AMIDE GROUP, SULFONIC GROUP, AND SULFONATE ESTER GROUP, METHOD FOR PRODUCING THE SAME, AND CHARGE CONTROL AGENT, TONER, IMAGE FORMING METHOD, AND IMAGE FORMING APPARATUS CANON KK (JP) 2006-09-06 EP disclosed
US-7056708-B2 Method of producing polyhydroxyalkanoate from alkane having residue containing aromatic ring in its molecule CANON KABUSHIKI KAISHA (JP) 2006-06-06 US disclosed
EP-1367078-B1 Method of producing polyhydroxyalkanoate from alkane having residue containing aromatic ring in its molecule CANON KK (JP) 2006-04-19 EP disclosed
US-20030207412-A1 Method of producing polyhydroxyalkanoate from alkane having residue containing aromatic ring in its molecule CANON KABUSHIKI KAISHA (JP) 2003-11-06 US disclosed
US-20030208029-A1 Polyhydroxyalkanoate, method for production thereof and microorganisms for use in the same CANON KABUSHIKI KAISHA (JP) 2003-11-06 US disclosed
EP-1340777-A1 Novel polyhydroxyalkanoate, method of producing the same, charge controlling agent containing polyhydroxyalkanoate, toner binder and toner, and image formation method and image forming apparatus using toner CANON KABUSHIKI KAISHA (JP) 2003-09-03 EP disclosed
EP-1336635-A1 Polyhydroxyalkanoate having amide group and sulfonic group, method of producing the same, charge controlling agent containing the polyhydroxyalkanoate, toner binder, toner, and image formation method and image forming apparatus using the toner CANON KABUSHIKI KAISHA (JP) 2003-08-20 EP disclosed
US-20030073804-A1 Polyhydroxyalkanoate, producing method therefor charge control agent containing such polyhydroxyalkanoate, toner containing such charge control agent and image forming method and image forming apparatus utilizing such toner CANON KABUSHIKI KAISHA (JP) 2003-04-17 US disclosed
US-6479621-B2 PRODUCED BY MICROORGANISMS; BIODEGRADATION, BIOCOMPATIBILITY CANON KABUSHIKI KAISHA (JP) 2002-11-12 US disclosed
EP-1236754-A2 Polyhydroxyalkanoate and method of producing same, and omega-(2-thienylsulfanyl) alkanoic acid and method of producing same CANON KABUSHIKI KAISHA (JP) 2002-09-04 EP disclosed
US-20020065389-A1 Polyhydroxyalkanoate containing 3-hydroxythienylalkanoic acid as monomer unit and method for producing the same CANON KABUSHIKI KAISHA (JP) 2002-05-30 US disclosed
EP-1130043-A2 Polyhydroxylalkanoate containing 3-hydroxythienylalkanoic acid as monomer unit and method for producing the same CANON KABUSHIKI KAISHA (JP) 2001-09-05 EP disclosed
EP-1113033-A2 Polyhydroxyalkanoate, method for production thereof and microorganisms for use in the same CANON KABUSHIKI KAISHA (JP) 2001-07-04 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 (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-20060263432-A1 Useful as a sustained release pharmaceutical preparation; microcapsule stably containing a drug, especially a water-soluble drug at high content and which has magnetic property; drug delivery; excellent in dispersibility and magnetic response SKP1, HAMP, AUP1 KMT2A 3735/4885SMN1; SMN2 3508/4885KDM4E 2061/4885

“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.