SCHEMBL4833883

SCHEMBL4833883

OC(CNc1nccs1)COc1ccc(-c2nc3cc(Br)cnc3[nH]2)cc1

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
Trifluoroacetic Acid SCHEMBL4834350 0.93 SCD (0.36)
SCHEMBL4843804 0.84 HDAC3 (0.35)
SCHEMBL6247249 0.83 KDM4E (0.40)
SCHEMBL4841793 0.80 MAPT (0.41)
SCHEMBL4843854 0.79 KMT2A (0.48)
Trifluoroacetic Acid SCHEMBL4839359 0.79 SCD (0.38)
SCHEMBL4845549 0.79 NPC1 (0.40)
SCHEMBL5263244 0.79 ALDH1A1 (0.49)
SCHEMBL4834900 0.79 MAPT (0.45)
SCHEMBL4838763 0.78 MEN1 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539759-B1 NOVEL IMIDAZOPYRIDINES AND THEIR USE ASTRAZENECA AB (SE) 2007-08-15 EP claimed
US-20050261333-A1 Use of and some novel imidazopyridines ASTRAZENECA A B (SE) 2005-11-24 US claimed
US-7410966-B2 Use of and some novel imidazopyridines ASTRAZENECA AB (SE) 2008-08-12 US disclosed
EP-1539759-B1 NOVEL IMIDAZOPYRIDINES AND THEIR USE ASTRAZENECA AB (SE) 2007-08-15 EP disclosed
US-20050261333-A1 Use of and some novel imidazopyridines ASTRAZENECA A B (SE) 2005-11-24 US disclosed