SCHEMBL13610071

SCHEMBL13610071

COCCCNc1nc(NC(C)COC)nc(NC(C)COC)c1N=Nc1nn(-c2nc3ccc(C(C)=O)cc3s2)cc1C#N

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 3/20 0.33
▸ CA2 P00918 3/20 0.33
▸ CA9 Q16790 3/20 0.33
▸ CFTR P13569 1/20 0.32
▸ PCSK9 Q8NBP7 1/20 0.31
▸ CA1 P00915 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL13610075 0.94 CA12 (0.32) CA12CA2CA9CA1
SCHEMBL10233109 0.88 MAPT (0.35) CA12CA2CA9CA1KDM4E
SCHEMBL13610063 0.86 MAPT (0.33) KDM4ESMN1; SMN2
SCHEMBL13610052 0.85 CA12 (0.31) CA12CA2CA9
SCHEMBL13610044 0.85 CA12 (0.34) CA12CA2CA9CA1SMN1; SMN2
SCHEMBL13347798 0.83 BRD4 (0.30) —
SCHEMBL14506740 0.82 MAPT (0.32) KDM4E
SCHEMBL13472082 0.82 — —
SCHEMBL13347799 0.82 BRD4 (0.30) —
SCHEMBL10233112 0.80 KDM4E (0.30) KDM4E

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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