SCHEMBL372338

SCHEMBL372338

O=C1C=CC=C/C1=C/NCCN/C=C1/C=CC=CC1=O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL1951120 0.98
SCHEMBL17607675 0.91
SCHEMBL2681743 0.78 POLB (0.31)
SCHEMBL2596949 0.74 POLB (0.33)
SCHEMBL28899961 0.68 ALDH1A1 (0.34)
SCHEMBL12809869 0.67 ALDH1A1 (0.43)
SCHEMBL13325913 0.67 ALDH1A1 (0.43)
SCHEMBL12162192 0.65
SCHEMBL22272191 0.62 POLB (0.30)
SCHEMBL113494 0.61

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
US-10464960-B2 Salen complexes with dianionic counterions SAUDI ARAMCO TECHNOLOGIES COMPANY (SA) 2019-11-05 US disclosed
US-20170107241-A1 SALEN COMPLEXES WITH DIANIONIC COUNTERIONS NOVOMER, INC. (US) 2017-04-20 US disclosed
US-9403861-B2 Salen complexes with dianionic counterions NOVOMER, INC. (US) 2016-08-02 US disclosed
EP-2755990-B1 METHOD FOR PREPARATION OF BETULINIC ACID STORA ENSO OYJ (FI) 2016-07-20 EP disclosed
US-20140336354-A1 SALEN COMPLEXES WITH DIANIONIC COUNTERIONS SAUDI ARAMCO TECHNOLOGIES COMPANY (SA) 2014-11-13 US disclosed
EP-2755990-A1 METHOD FOR PREPARATION OF BETULINIC ACID Stora Enso Oyj (FI) 2014-07-23 EP disclosed
EP-2595951-B1 A PROCESS FOR THE PRODUCTION OF CARNITINE LONZA AG (CH) 2014-04-16 EP disclosed
US-8563752-B2 Process for the production of carnitine by cycloaddition LONZA LTD. (CH) 2013-10-22 US disclosed
WO-2013090276-A1 SALEN COMPLEXES WITH DIANIONIC COUNTERIONS NOVOMER, INC. (US) 2013-06-20 WO disclosed
EP-2595951-A1 A PROCESS FOR THE PRODUCTION OF CARNITINE Lonza Ltd. (CH) 2013-05-29 EP disclosed
WO-2013038312-A1 METHOD FOR PREPARATION OF BETULINIC ACID STORA ENSO OYJ (FI) 2013-03-21 WO disclosed
US-20120022275-A1 PROCESS FOR THE PRODUCTION OF CARNITINE BY CYCLOADDITION LONZA LTD. (CH) 2012-01-26 US disclosed
WO-2012010296-A1 A PROCESS FOR THE PRODUCTION OF CARNITINE LONZA LTD (CH) 2012-01-26 WO disclosed
EP-2409965-A1 A process for the production of carnitine by cycloaddition Lonza Ltd. (CH) 2012-01-25 EP disclosed