SCHEMBL308765

SCHEMBL308765

[O-][n+]1ccc(Br)cc1-c1ccccn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.42
LMNA P02545 4/20 0.42
CCR1 P32246 3/20 0.42
CCR5 P51681 3/20 0.42
CCR8 P51685 3/20 0.42
CYP1A2 P05177 2/20 0.42
POLB P06746 1/20 0.42
METAP1 P53582 1/20 0.42
BLM P54132 1/20 0.42
HIF1A Q16665 1/20 0.42
DOHH Q9BU89 1/20 0.42
P4HTM Q9NXG6 1/20 0.42
GRM5 P41594 2/20 0.39
NPC1 O15118 5/20 0.38
RAB9A P51151 5/20 0.38
MAPT P10636 2/20 0.38
ATM Q13315 1/20 0.38
HTT P42858 4/20 0.37
TP53 P04637 3/20 0.37
L3MBTL1 Q9Y468 3/20 0.37

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
SCHEMBL16125565 0.83 SPR (0.35) KDM4ESMN1; SMN2ALDH1A1
SCHEMBL9598969 0.80 KDM4E (0.42) KDM4ELMNACCR1CCR5CCR8
SCHEMBL30305663 0.77 KDM4E (0.50) KDM4ELMNACCR1CCR5CCR8
SCHEMBL1367622 0.76 NPC1 (0.44) KDM4ELMNACCR1CCR5CCR8
SCHEMBL12938268 0.75 HDAC8 (0.36) MAPTHTTHSP90AA1
SCHEMBL308654 0.75 MAPT (0.47) KDM4ELMNACYP1A2METAP1GRM5
SCHEMBL13582642 0.73 KDM4E (0.35) KDM4ELMNACCR1CCR5CCR8
SCHEMBL308766 0.73 HTT (0.38) KDM4ELMNAMAPTHTTTDP1
SCHEMBL18093544 0.72 CYP2A6 (0.46) KDM4ELMNACCR1CCR5CCR8
Methoxymethane SCHEMBL4134582 0.71 KDM4E (0.43) KDM4ELMNACCR1CCR5CCR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10219730-B2 Redox polymers ABBOTT DIABETES CARE INC. (US) 2019-03-05 US disclosed
US-20160296147-A1 Redox Polymers THERASENSE, INC. 2016-10-13 US disclosed
US-9320467-B2 Redox polymers ABBOTT DIABETES CARE INC. (US) 2016-04-26 US disclosed
US-9324504-B2 Organic metal dye, and photoelectric element and dye-sensitized solar cell using the organic metal dye SFC CO., LTD. (KR) 2016-04-26 US disclosed
US-20140364710-A1 Redox Polymers THERASENSE, INC. 2014-12-11 US disclosed
US-8828204-B2 Redox polymers ABBOTT DIABETES CARE INC. (US) 2014-09-09 US disclosed
US-8795490-B2 Redox polymers ABBOTT DIABETES CARE INC. (US) 2014-08-05 US disclosed
US-8512534-B2 Redox polymers ABBOTT DIABETES CARE INC. (US) 2013-08-20 US disclosed
US-20120247546-A1 ORGANIC METAL DYE, AND PHOTOELECTRIC ELEMENT AND DYE-SENSITIZED SOLAR CELL USING THE ORGANIC METAL DYE SFC CO., LTD. (KR) 2012-10-04 US disclosed
US-8168052-B2 Transition metal complexes with bidentate ligand having an imidazole ring ABBOTT DIABETES CARE INC. (US) 2012-05-01 US disclosed
US-8092662-B2 Redox polymers ABBOTT DIABETES CARE INC. (US) 2012-01-10 US disclosed
US-20110303538-A1 Redox Polymers ABBOTT DIABETES CARE INC. 2011-12-15 US disclosed
US-20110303537-A1 Redox Polymers ABBOTT DIABETES CARE INC. 2011-12-15 US disclosed
US-20110306111-A1 Redox Polymers ABBOTT DIABETES CARE INC. 2011-12-15 US disclosed
US-20100288634-A1 Transition Metal Complexes with Bidentate Ligand Having an Imidazole Ring ABBOTT DIABETES CARE INC. 2010-11-18 US disclosed
EP-1230248-B1 TRANSITION METAL COMPLEXES ATTACHED TO A POLYMER VIA A FLEXIBLE CHAIN THERASENSE INC (US) 2007-06-06 EP disclosed
US-6605200-B1 Charge transfer compounds comprising polymers such as polyvinylpyridine and/or copolymers coupled to osmium compounds, used as biosensors in redox systems THERASENSE, INC. 2003-08-12 US disclosed
EP-1230248-A2 TRANSITION METAL COMPLEXES ATTACHED TO A POLYMER VIA A FLEXIBLE CHAIN Therasense, Inc. (US) 2002-08-14 EP disclosed
WO-2001036660-A2 TRANSITION METAL COMPLEXES ATTACHED TO A POLYMER VIA A FLEXIBLE CHAIN THERASENSE, INC. (US) 2001-05-25 WO 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-20120247546-A1 ORGANIC METAL DYE, AND PHOTOELECTRIC ELEMENT AND DYE-SENSITIZED SOLAR CELL USING THE ORGANIC METAL DYE PPOX, LAGE3, TYR KDM4E 749/4885LMNA 3505/4885CCR1 3525/4885
US-10219730-B2 Redox polymers PPOX, OTC, ME3 KDM4E 2030/4885LMNA 4829/4885CCR1 4831/4885

“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.