SCHEMBL16884753

SCHEMBL16884753

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc(-c5ccc6c(c5)-c5ccccc5-c5ccccc5N6c5ccccc5)c4)c3)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE6D O43924 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ MAPT P10636 3/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ HPGD P15428 2/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.36
▸ CES2 O00748 1/20 0.36
▸ BCHE P06276 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ CES1 P23141 1/20 0.36
▸ LMNA P02545 3/20 0.36
▸ POLB P06746 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ GLA P06280 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ APAF1 O14727 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ THRB P10828 1/20 0.34

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
SCHEMBL16884752 1.00 PDE6D (0.39) PDE6DALDH1A1MEN1MAPTKMT2A
SCHEMBL16884830 0.97 MEN1 (0.38) PDE6DALDH1A1MEN1MAPTKMT2A
SCHEMBL18194128 0.96 PDE6D (0.38) PDE6DALDH1A1MEN1MAPTKMT2A
SCHEMBL16884747 0.96 ALDH1A1 (0.39) PDE6DALDH1A1MEN1MAPTKMT2A
SCHEMBL16884770 0.94 MEN1 (0.41) PDE6DALDH1A1MEN1MAPTKMT2A
SCHEMBL16884769 0.94 MEN1 (0.41) PDE6DALDH1A1MEN1MAPTKMT2A
SCHEMBL16884748 0.94 PDE6D (0.40) PDE6DALDH1A1MEN1MAPTKMT2A
SCHEMBL16884808 0.93 ALDH1A1 (0.41) PDE6DALDH1A1MEN1MAPTKMT2A
SCHEMBL16884804 0.93 MEN1 (0.40) PDE6DALDH1A1MEN1MAPTKMT2A
SCHEMBL16884756 0.92 MEN1 (0.42) PDE6DALDH1A1MEN1MAPTKMT2A

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-20150194610-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-07-09 — — US disclosed
US-20150194610-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-07-09 — — US disclosed
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