SCHEMBL19843403

SCHEMBL19843403

Cc1nc(C)nc(-c2cccc3c4cccc(-c5nc(C)nc(C)n5)c4n(-c4cccc5c4C(=O)N(c4ccc(-c6ccccc6)cc4)C5=O)c23)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE6D O43924 1/20 0.49
▸ USP2 O75604 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ HTT P42858 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ TNNI3 P19429 1/20 0.42
▸ TNNT2 P45379 1/20 0.42
▸ TNNC1 P63316 1/20 0.42
▸ TYMS P04818 3/20 0.41
▸ ADORA2A P29274 1/20 0.40
▸ HSPA1A P0DMV8 1/20 0.40
▸ PABPC1 P11940 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ KDM4E B2RXH2 3/20 0.38
▸ RXFP1 Q9HBX9 2/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ KEAP1 Q14145 1/20 0.37

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
SCHEMBL19843402 0.95 PDE6D (0.46) PDE6DUSP2KMT2AMEN1MAPT
SCHEMBL19843466 0.92 TYMS (0.40) PDE6DUSP2KMT2AMEN1MAPT
SCHEMBL23476538 0.92 TYMS (0.42) PDE6DUSP2KMT2AMEN1MAPT
SCHEMBL19843380 0.90 PDE6D (0.52) PDE6DUSP2KMT2AMEN1MAPT
SCHEMBL19842953 0.89 NR1H2 (0.45) PDE6DUSP2KMT2AMEN1MAPT
SCHEMBL19843473 0.89 TYMS (0.48) PDE6DUSP2KMT2AMEN1MAPT
SCHEMBL19843553 0.88 TYMS (0.37) PDE6DUSP2KMT2AMEN1MAPT
SCHEMBL19843331 0.88 TYMS (0.45) PDE6DUSP2KMT2AMEN1MAPT
SCHEMBL19843195 0.87 TYMS (0.39) PDE6DUSP2KMT2AMEN1MAPT
SCHEMBL19843546 0.87 TYMS (0.42) PDE6DUSP2KMT2AMEN1MAPT

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
WO-2018024725-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-08 — — WO disclosed
EP-3279194-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-07 — — EP disclosed
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