SCHEMBL9952075

SCHEMBL9952075

[Li]c1ccnnn1

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
SCHEMBL379708 0.71 KDM4E (0.32)
SCHEMBL31132443 0.71
Charcoal, Activated SCHEMBL30558882 0.69 KDM4E (0.31)
SCHEMBL4457 0.67
SCHEMBL587315 0.67
SCHEMBL2320497 0.67
SCHEMBL20783 0.67
SCHEMBL185511 0.67
SCHEMBL2909038 0.67
SCHEMBL687677 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103380126-B Process for preparing 2- (triazinylcarbonyl) sulfonanilides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-01-20 CN disclosed
US-9096551-B2 Method for producing 2-(triazinylcarbonyl) sulfonanilides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-08-04 US disclosed
US-20140024828-A1 Method for producing 2-(triazinylcarbonyl) sulfonanilides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-01-23 US disclosed
EP-2655346-A2 METHOD FOR PRODUCING 2-(TRIAZINYLCARBONYL) SULFONANILIDES Bayer Intellectual Property GmbH (DE) 2013-10-30 EP disclosed
CN-103380126-A Process for preparing 2- (triazinylcarbonyl) sulfonanilides BAYER IP GMBH 2013-10-30 CN disclosed
WO-2012084857-A2 METHOD FOR PRODUCING 2-(TRIAZINYLCARBONYL) SULFONANILIDES BAYER CROPSCIENCE AG (DE) 2012-06-28 WO disclosed