SCHEMBL16144406

SCHEMBL16144406

Fc1ccccc1N(c1ccccc1)c1ccc2ccc3c(N(c4ccc5ccccc5c4)c4cnc5ccccc5n4)ccc4ccc1c2c43

nearest known ligand 0.30

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.30
NPC1 O15118 2/20 0.30
MAPT P10636 2/20 0.30
RAB9A P51151 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
KMT2A Q03164 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
SCHEMBL16144489 0.93 SMN1; SMN2 (0.34) KDM4ENPC1MAPTRAB9ASMN1; SMN2
SCHEMBL16144506 0.89 NCF1 (0.33)
SCHEMBL16144407 0.87 NPC1 (0.33) NPC1
SCHEMBL16144483 0.85 ALDH1A1 (0.31) L3MBTL1ALDH1A1
SCHEMBL16144456 0.84 NOS3 (0.32)
SCHEMBL16144405 0.84 SYK (0.31)
SCHEMBL16144404 0.83 ALDH1A1 (0.32) L3MBTL1ALDH1A1
SCHEMBL16144437 0.82 SMN1; SMN2 (0.39) KDM4ENPC1MAPTRAB9ASMN1; SMN2
SCHEMBL16144393 0.82 SLC6A2 (0.31)
SCHEMBL16144491 0.82 NPC1 (0.35) NPC1L3MBTL1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9583718-B2 Pyrene-based compound and organic light-emitting diode including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-28 US disclosed
US-9583718-B2 Pyrene-based compound and organic light-emitting diode including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-28 US disclosed
US-20140291646-A1 PYRENE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-10-02 US disclosed
US-20140291646-A1 PYRENE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-10-02 US disclosed