SCHEMBL16144456

SCHEMBL16144456

Fc1ccccc1N(c1ccccc1)c1ccc2ccc3c(N(c4ccc5ccccc5c4)c4cnccn4)ccc4ccc1c2c43

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 3/20 0.32
NOS1 P29475 3/20 0.32
NOS2 P35228 3/20 0.32
HDAC6 Q9UBN7 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
SCHEMBL16144450 0.93 NOS3 (0.33) NOS3NOS1NOS2HDAC6
SCHEMBL16144483 0.89 ALDH1A1 (0.31)
SCHEMBL16144407 0.87 NPC1 (0.33)
SCHEMBL16144393 0.86 SLC6A2 (0.31) NOS3NOS1NOS2
SCHEMBL16144404 0.85 ALDH1A1 (0.32)
SCHEMBL16144406 0.84 KDM4E (0.30)
SCHEMBL16144506 0.82 NCF1 (0.33)
SCHEMBL16144403 0.82
SCHEMBL16144401 0.82 HDAC6 (0.36) NOS3NOS1NOS2HDAC6
SCHEMBL16144408 0.82 CCR1 (0.31)

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