SCHEMBL4993044

SCHEMBL4993044

Brc1csc(-n2[c]ncc2)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
SCHEMBL6512058 0.68 POLB (0.31)
SCHEMBL2096975 0.57
SCHEMBL5438607 0.57
SCHEMBL20185030 0.54
SCHEMBL4371554 0.53
SCHEMBL20298922 0.53
SCHEMBL7015002 0.53
SCHEMBL9515906 0.53
SCHEMBL2094941 0.52 NOTUM (0.41)
SCHEMBL9162666 0.52 KDM4E (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080188518-A1 5-Substituted Imidazoles ASTRA ZENECA AB (SE) 2008-08-07 US disclosed
US-7384954-B2 4-substituted imidazoles ASTRAZENECA AB (SE) 2008-06-10 US disclosed
US-20070105896-A1 4-Substituted imidazoles ASTRAZENECA AB (SE) 2007-05-10 US disclosed
EP-1687303-A1 4-SUBSTITUTED IMIDAZOLES AstraZeneca AB (SE) 2006-08-09 EP disclosed
EP-1687302-A1 5-SUBSTITUTED IMIDAZOLES AstraZeneca AB (SE) 2006-08-09 EP disclosed
WO-2005049611-A1 5-SUBSTITUTED IMIDAZOLES ASTRAZENECA AB (SE) 2005-06-02 WO disclosed
WO-2005049612-A1 4-SUBSTITUTED IMIDAZOLES ASTRAZENECA AB (SE) 2005-06-02 WO disclosed