SCHEMBL4768349

SCHEMBL4768349

CCN=C=NCCC(CC)N(C)C

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47

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
Hydrochloric Acid SCHEMBL8073423 0.98 CYP1A2 (0.46) CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL15303105 0.87 CYP1A2 (0.52) CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL7853433 0.80 CYP1A2 (0.44) CYP1A2CYP2D6
SCHEMBL28829996 0.80 CYP1A2 (0.44) CYP1A2CYP2D6
SCHEMBL28042099 0.79 CYP1A2 (0.50) CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL28709853 0.79 CYP1A2 (0.43) CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL7737390 0.79 CYP1A2 (0.61) CYP1A2CYP2D6
SCHEMBL7986350 0.78 CYP1A2 (0.48) CYP1A2CYP2D6
SCHEMBL3164457 0.78
SCHEMBL27963869 0.76 CYP1A2 (0.47) CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0649536-B1 ASSAY FOR CHAGAS' DISEASE AND REAGENTS FOR ITS USE ABBOTT LAB (US) 2002-04-24 EP claimed
EP-0203959-B1 NUCLEOTIDE ANALOGS FOR NUCLEIC ACID LABELING AND DETECTION LIFE TECHNOLOGIES, INC. (US) 1992-09-09 EP claimed
EP-3619242-A1 METHOD FOR PRODUCING HYDROGEL FROM MODIFIED HYALURONIC ACID AND TYPE 1 COLLAGEN HCS Pharma (FR) 2020-03-11 EP disclosed
WO-2016166479-A1 METHOD FOR PRODUCING HYDROGEL FROM MODIFIED HYALURONIC ACID AND TYPE 1 COLLAGEN CELENYS (FR) 2016-10-20 WO disclosed
EP-2653164-A1 Type 5 and type 8 capsular polysaccharides of over-productive strains of S. aureus Sanofi Pasteur (FR) 2013-10-23 EP disclosed
EP-2004223-A1 TYPE 5 AND TYPE 8 CAPSULAR POLYSACCHARIDES OF SUPERPRODUCING STAPHYLOCOCCUS AUREUS STRAINS Sanofi Pasteur (FR) 2008-12-24 EP disclosed
WO-2007118979-A1 TYPE 5 AND TYPE 8 CAPSULAR POLYSACCHARIDES OF SUPERPRODUCING STAPHYLOCOCCUS AUREUS STRAINS SANOFI PASTEUR (FR) 2007-10-25 WO disclosed
JP-2003180815-A RESORBABLE EXTRACELLULAR MATRIX CONTAINING COLLAGEN I AND COLLAGEN II FOR RECONSTRUCTION OF CARTILAGE ED GEISTLICH SOEHNE AG FUER CHEMISCHE INDUSTRIE 2003-07-02 JP disclosed