SCHEMBL13805889

SCHEMBL13805889

CCCNC(=O)N1N=C(C(C)=O)/C(=C\C=C2N(C)c3ccccc3N2C)C1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 2/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ POLB P06746 3/20 0.34
▸ THRB P10828 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ PSEN1 P49768 2/20 0.33
▸ PSEN2 P49810 2/20 0.33
▸ APH1B Q8WW43 2/20 0.33
▸ NCSTN Q92542 2/20 0.33
▸ APH1A Q96BI3 2/20 0.33
▸ PSENEN Q9NZ42 2/20 0.33
▸ ASAH1 Q13510 3/20 0.33
▸ HPGD P15428 1/20 0.32
▸ CDC25A P30304 1/20 0.32
▸ TRPA1 O75762 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ MTOR P42345 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 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
SCHEMBL13683639 0.86 TRPA1 (0.35) BCHETRPA1NPC1MTORRAB9A
SCHEMBL13683638 0.78 CDC25A (0.36) NPSR1CDC25ATRPA1NPC1MTOR
SCHEMBL13683624 0.78 TRPA1 (0.40) L3MBTL1TRPA1NPC1MTORRAB9A
SCHEMBL13683637 0.74 MAPT (0.40) BCHEPOLBL3MBTL1HPGDMEN1
SCHEMBL13683654 0.72 ALDH1A1 (0.41) BCHENPSR1POLBTHRBL3MBTL1
SCHEMBL13683523 0.70 ALDH1A1 (0.39) BCHENPSR1POLBHPGDMEN1
SCHEMBL13683651 0.70 ALDH1A1 (0.39) BCHENPSR1PSEN1PSEN2APH1B
SCHEMBL13683628 0.69 TRPA1 (0.35) L3MBTL1CDC25ATRPA1NPC1MTOR
SCHEMBL13683629 0.68 MAPT (0.42) NPSR1POLBL3MBTL1HPGDNPC1
SCHEMBL13683632 0.68 MAPT (0.40) POLBL3MBTL1HPGDCDC25AMEN1

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-7553797-B2 Thermal transfer recording material and thermal transfer recording method KONICA MINOLTA PHOTO IMAGING, INC. (JP) 2009-06-30 — — US disclosed
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