SCHEMBL17088289

SCHEMBL17088289

COc1nc(C#N)c(C#N)nc1C

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.40
GAA P10253 1/20 0.38
USP8 P40818 6/20 0.37
USP7 Q93009 3/20 0.36
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.33
SQOR Q9Y6N5 1/20 0.33
MAPK1 P28482 2/20 0.31
TSHR P16473 2/20 0.31
POLB P06746 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PDE10A Q9Y233 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL10924100 0.89 RECQL (0.39) RECQLGAAUSP8USP7KDM4E
SCHEMBL20261935 0.85 RECQL (0.41) RECQLGAAUSP8USP7KDM4E
SCHEMBL30688772 0.77 USP8 (0.35) GAAUSP8USP7KDM4EMEN1
SCHEMBL2488974 0.77 USP8 (0.35) GAAUSP8USP7KDM4EMEN1
SCHEMBL14316179 0.76 USP8 (0.39) RECQLGAAUSP8USP7KDM4E
SCHEMBL11402288 0.76 KDM4E (0.37) RECQLGAAUSP8USP7KDM4E
SCHEMBL17427734 0.75 USP8 (0.40) RECQLGAAUSP8KDM4EMEN1
SCHEMBL14316177 0.71 USP8 (0.46) RECQLGAAUSP8USP7KDM4E
SCHEMBL11093146 0.71 USP8 (0.37) GAAUSP8KDM4EALDH1A1SQOR
SCHEMBL30659955 0.71 SMN1; SMN2 (0.53) GAAKDM4EMEN1KMT2AALDH1A1

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-9139954-B2 Aqueous coloring composition for textile printing, textile printing method, and fabric FUJIFILM CORPORATION (JP) 2015-09-22 US disclosed
US-9139954-B2 Aqueous coloring composition for textile printing, textile printing method, and fabric FUJIFILM CORPORATION (JP) 2015-09-22 US disclosed