SCHEMBL13610053

SCHEMBL13610053

C=CC(=O)OCCNc1nc(NC(C)COC)c(C#N)c(C)c1N=Nc1nn(-c2ncns2)cc1C#N

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
SCHEMBL13610059 0.79 — —
SCHEMBL13610050 0.78 — —
SCHEMBL13610078 0.77 LRRK2 (0.31) —
SCHEMBL13610057 0.75 — —
SCHEMBL13610038 0.74 — —
SCHEMBL13610037 0.74 CA12 (0.31) —
SCHEMBL13610045 0.74 RAB9A (0.33) —
SCHEMBL14533557 0.73 — —
SCHEMBL13610049 0.73 — —
SCHEMBL13610054 0.73 KDM4E (0.32) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7622521-B2 Colored curable composition, color filter and method of producing thereof FUJIFILM CORPORATION (JP) 2009-11-24 — — US disclosed
US-20070112134-A1 Colored curable composition, color filter and method of producing thereof FUJIFILM CORPORATION 2007-05-17 — — US disclosed
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