SCHEMBL13610047

SCHEMBL13610047

COCCCNc1nc(NCCCOC=O)c(C#N)c(C)c1N=Nc1nn(-c2nc3ccccc3s2)cc1C#N

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.34
▸ KMT2A Q03164 2/20 0.33
▸ KDM4E B2RXH2 4/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ POLB P06746 2/20 0.32
▸ CA12 O43570 3/20 0.31
▸ CA2 P00918 3/20 0.31
▸ CA9 Q16790 3/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ CA1 P00915 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ PKM P14618 1/20 0.31

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
SCHEMBL14506740 0.86 MAPT (0.32) MAPTKDM4EALDH1A1POLBRAB9A
SCHEMBL13610059 0.84 — —
SCHEMBL13929503 0.82 MAPT (0.38) MAPTKMT2AKDM4EALDH1A1POLB
SCHEMBL13134117 0.81 RAB9A (0.34) MAPTKMT2AKDM4EALDH1A1CA12
SCHEMBL10233130 0.80 KDM4E (0.39) MAPTKMT2AKDM4EALDH1A1CA12
SCHEMBL13310999 0.80 MAPT (0.35) MAPTKMT2AKDM4EALDH1A1POLB
SCHEMBL13610037 0.80 CA12 (0.31) CA12CA2CA9
SCHEMBL10233139 0.80 KDM4E (0.38) MAPTKMT2AKDM4EALDH1A1CA12
SCHEMBL10233109 0.79 MAPT (0.35) MAPTKMT2AKDM4EALDH1A1POLB
SCHEMBL13311000 0.79 KDM4E (0.38) MAPTKMT2AKDM4EALDH1A1CA12

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 1 patent. 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
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