SCHEMBL129101

SCHEMBL129101

[CH2]Cc1cn[nH]c1

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
SCHEMBL28229251 1.00
Ammonia Solution, Strong SCHEMBL27793753 0.95
SCHEMBL3103249 0.80
SCHEMBL21263656 0.78 NOS2 (0.44)
SCHEMBL14131007 0.78 NOS2 (0.44)
SCHEMBL292535 0.77
SCHEMBL7350898 0.74
SCHEMBL12821996 0.74
SCHEMBL2976691 0.73
SCHEMBL24866428 0.72 AKT2 (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11673883-B2 Heterocyclic compounds as immunomodulators INCYTE CORPORATION (US) 2023-06-13 US claimed
CN-114075174-A Heat-resistant explosive and synthesis method thereof 南京理工大学 2022-02-22 CN claimed
EP-3464279-B1 HETEROCYCLIC COMPOUNDS AS IMMUNOMODULATORS INCYTE CORP (US) 2021-11-24 EP claimed
EP-3464279-A1 HETEROCYCLIC COMPOUNDS AS IMMUNOMODULATORS Incyte Corporation (US) 2019-04-10 EP claimed
CN-105143207-B Substituted pyridine and substituted pyrazine compounds as PDE4 inhibitors 达特神经科学(开曼)有限公司 2018-04-24 CN claimed
CN-107935929-A 3 trifluoromethyl 1H pyrazoles of a kind of 1 methyl, 4 amide derivatives and preparation method and application 浙江工业大学 2018-04-20 CN claimed
US-20170342060-A1 HETEROCYCLIC COMPOUNDS AS IMMUNOMODULATORS INCYTE CORPORATION 2017-11-30 US claimed
WO-2017205464-A1 HETEROCYCLIC COMPOUNDS AS IMMUNOMODULATORS INCYTE CORPORATION (US) 2017-11-30 WO claimed
EP-3050873-B1 SULFUR DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN INC (US) 2017-09-13 EP claimed
CN-107033084-A A kind of acyl urea compound for containing 1,3 dimethyl 1H pyrrazole structures and its preparation method and application 浙江工业大学 2017-08-11 CN claimed
CN-101421257-A Agents that disrupt cellular replication and their use in inhibiting pathological conditions EUROPEAN MOLECULAR BIOLOGY LAB EMBL (DE) 2009-04-29 CN claimed
WO-2007107352-A1 AGENTS THAT DISRUPT CELLULAR REPLICATION AND THEIR USE IN INHIBITING PATHOLOGICAL CONDITIONS THE EUROPEAN MOLECULAR BIOLOGY LABORATORY (DE) 2007-09-27 WO claimed
US-6969728-B2 Antiinflammatory agents GENZYME CORPORATION (US) 2005-11-29 US claimed
EP-1567138-A1 USE OF DIAMIDE DERIVATIVES FOR INHIBITING CHRONIC TISSUE TRANSPLANT REJECTION Genzyme Corporation (US) 2005-08-31 EP claimed
US-20040163654-A1 Inhibition of chronic tissue transplant rejection GENZYME CORPORATION 2004-08-26 US claimed
WO-2004047825-A1 USE OF DIAMIDE DERIVATIVES FOR INHIBITING CHRONIC TISSUE TRANSPLANT REJECTION GENZYME CORPORATION (US) 2004-06-10 WO claimed
CN-1441787-A Modulators of TNF-alpha signaling GENZYME CORP (US) 2003-09-10 CN claimed
EP-1294699-A2 MODULATORS OF TNF- ALPHA SIGNALLING GENZYME CORPORATION (US) 2003-03-26 EP claimed
US-20020119988-A1 Antiinflammatory agents GENZYME CORPORATION 2002-08-29 US claimed
WO-2001087849-A2 MODULATORS OF TNF- ALPHA SIGNALING GENZYME CORPORATION (US) 2001-11-22 WO claimed