SCHEMBL17622758

SCHEMBL17622758

CNO/C(C)=C/c1ncnc(NC)c1C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ YTHDC1 Q96MU7 1/20 0.32
▸ YTHDF2 Q9Y5A9 1/20 0.32

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
SCHEMBL16091477 0.85 — —
SCHEMBL17623004 0.85 MAPK13 (0.32) —
SCHEMBL16091376 0.85 KDM4E (0.32) —
SCHEMBL16091493 0.82 — —
SCHEMBL17623469 0.82 CHEK1 (0.30) —
SCHEMBL16091227 0.81 TKT (0.32) —
SCHEMBL16091214 0.81 AURKA (0.34) —
SCHEMBL17623358 0.80 — —
SCHEMBL16091292 0.78 — —
SCHEMBL16091488 0.77 ACACB (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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016044641-A2 CARM1 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-03-24 — — WO disclosed
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