SCHEMBL17817839

SCHEMBL17817839

COc1ccc(N(c2ccc(OC)cc2)c2ccc(N(c3ccc([N+](=O)[O-])cc3)c3ccc([N+](=O)[O-])cc3)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.61
MEN1 O00255 4/20 0.61
KMT2A Q03164 4/20 0.61
L3MBTL1 Q9Y468 2/20 0.61
CRHBP P24387 1/20 0.61
ATM Q13315 1/20 0.61
CRHR2 Q13324 1/20 0.61
TLR9 Q9NR96 1/20 0.61
APP P05067 1/20 0.58
LMNA P02545 3/20 0.53
POLB P06746 1/20 0.53
RAB9A P51151 4/20 0.51
NPC1 O15118 3/20 0.51
KCNJ1 P48048 1/20 0.51
KCNH2 Q12809 1/20 0.51
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
PTGS1 P23219 1/20 0.50
PTGS2 P35354 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49

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
SCHEMBL17817840 1.00 ALDH1A1 (0.61) ALDH1A1MEN1KMT2AL3MBTL1CRHBP
SCHEMBL15746105 1.00 ALDH1A1 (0.61) ALDH1A1MEN1KMT2AL3MBTL1CRHBP
SCHEMBL28048173 0.95 ALDH1A1 (0.56) ALDH1A1MEN1KMT2AL3MBTL1CRHBP
SCHEMBL17817837 0.92 ALDH1A1 (0.56) ALDH1A1MEN1KMT2AL3MBTL1CRHBP
SCHEMBL29702410 0.91 MAOA (0.53) ALDH1A1MEN1KMT2AL3MBTL1CRHBP
SCHEMBL20328415 0.88 APP (0.70) ALDH1A1MEN1KMT2AL3MBTL1TLR9
SCHEMBL20328414 0.88 APP (0.70) ALDH1A1MEN1KMT2AL3MBTL1TLR9
SCHEMBL492221 0.88 APP (0.70) ALDH1A1MEN1KMT2AL3MBTL1TLR9
SCHEMBL19343632 0.88 KCNJ1 (0.52) ALDH1A1MEN1KMT2AL3MBTL1CRHBP
SCHEMBL19343633 0.88 KCNJ1 (0.52) ALDH1A1MEN1KMT2AL3MBTL1CRHBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3231029-B1 ELECTRODE FOR AN ELECTROCHEMICAL ELEMENT WITH AN ORGANIC ELECTROLYTE, ELECTROCHEMICAL ELEMENTS COMPRISING THE ELECTRODE AND POLYMERIC MATERIAL AND ITS USE AS ELECTRODE ACTIVE MATERIAL OR AS ELECTRODE BINDER VARTA MICROBATTERY GMBH (DE) 2020-10-07 EP disclosed
US-10468715-B2 Composite material, electrode, method of producing the material and the electrode and electrochemical cell VARTA MICROBATTERY GMBH (DE) 2019-11-05 US disclosed
US-10388958-B2 Electrode for an electrochemical element with an organic electrolyte, electrochemical elements comprising the electrode and polymeric material and its use as electrode active material or as electrode binder VARTA MICRO INNOVATION GMBH (DE) 2019-08-20 US disclosed
EP-3154111-B1 COMPOSITE MATERIAL, ELECTRODE, METHOD TO PRODUCE THE MATERIAL AND THE ELECTRODE AND ELECTROCHEMICAL CELL COMPRISING THE ELECTRODE VARTA MICROBATTERY GMBH (DE) 2019-06-12 EP disclosed
US-20180287192-A1 COMPOSITE MATERIAL, ELECTRODE, METHOD OF PRODUCING THE MATERIAL AND THE ELECTRODE AND ELECTROCHEMICAL CELL DR. ING. H.C. F. PORSCHE AG (DE) 2018-10-04 US disclosed
EP-3231029-A1 ELECTRODE FOR AN ELECTROCHEMICAL ELEMENT WITH AN ORGANIC ELECTROLYTE, ELECTROCHEMICAL ELEMENTS COMPRISING THE ELECTRODE AND POLYMERIC MATERIAL AND ITS USE AS ELECTRODE ACTIVE MATERIAL OR AS ELECTRODE BINDER VARTA Micro Innovation GmbH (AT) 2017-10-18 EP disclosed
US-20170263934-A1 ELECTRODE FOR AN ELECTROCHEMICAL ELEMENT WITH AN ORGANIC ELECTROLYTE, ELECTROCHEMICAL ELEMENTS COMPRISING THE ELECTRODE AND POLYMERIC MATERIAL AND ITS USE AS ELECTRODE ACTIVE MATERIAL OR AS ELECTRODE BINDER DR. ING. H.C. F. PORSCHE AG (DE) 2017-09-14 US disclosed
US-20170263934-A1 ELECTRODE FOR AN ELECTROCHEMICAL ELEMENT WITH AN ORGANIC ELECTROLYTE, ELECTROCHEMICAL ELEMENTS COMPRISING THE ELECTRODE AND POLYMERIC MATERIAL AND ITS USE AS ELECTRODE ACTIVE MATERIAL OR AS ELECTRODE BINDER DR. ING. H.C. F. PORSCHE AG (DE) 2017-09-14 US disclosed
WO-2017060115-A1 COMPOSITE MATERIAL, ELECTRODE, METHOD TO PRODUCE THE MATERIAL AND THE ELECTRODE AND ELECTROCHEMICAL CELL COMPRISING THE ELECTRODE VARTA MICRO INNOVATION GMBH (AT) 2017-04-13 WO disclosed
WO-2017060115-A1 COMPOSITE MATERIAL, ELECTRODE, METHOD TO PRODUCE THE MATERIAL AND THE ELECTRODE AND ELECTROCHEMICAL CELL COMPRISING THE ELECTRODE VARTA MICRO INNOVATION GMBH (AT) 2017-04-13 WO disclosed
EP-3154111-A1 COMPOSITE MATERIAL, ELECTRODE, METHOD TO PRODUCE THE MATERIAL AND THE ELECTRODE AND ELECTROCHEMICAL CELL COMPRISING THE ELECTRODE VARTA Micro Innovation GmbH (AT) 2017-04-12 EP disclosed
EP-3154111-A1 COMPOSITE MATERIAL, ELECTRODE, METHOD TO PRODUCE THE MATERIAL AND THE ELECTRODE AND ELECTROCHEMICAL CELL COMPRISING THE ELECTRODE VARTA Micro Innovation GmbH (AT) 2017-04-12 EP disclosed
EP-3032621-A1 Electrode for an electrochemical element with an organic electrolyte, electrochemical elements comprising the electrode and polymeric material and its use as electrode active material or as electrode binder VARTA Micro Innovation GmbH (AT) 2016-06-15 EP disclosed
EP-3032621-A1 Electrode for an electrochemical element with an organic electrolyte, electrochemical elements comprising the electrode and polymeric material and its use as electrode active material or as electrode binder VARTA Micro Innovation GmbH (AT) 2016-06-15 EP disclosed