SCHEMBL16144388

SCHEMBL16144388

c1ccc(-c2cc(-c3ccccc3)cc(N(c3ccccc3)c3ccc4ccc5c(N(c6ccccc6)c6ncc7ccccc7n6)ccc6ccc3c4c65)c2)cc1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MET P08581 1/20 0.32
CYP1A2 P05177 1/20 0.32
PTGDR2 Q9Y5Y4 2/20 0.31
NPC1 O15118 1/20 0.31

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
SCHEMBL16144383 0.91 CYP1A2 (0.34) CYP1A2PTGDR2NPC1
SCHEMBL16144500 0.87 PTGDR2 (0.33) METPTGDR2NPC1
SCHEMBL16144487 0.85 PLG (0.31)
SCHEMBL12575566 0.83 CYP1A2 (0.33) CYP1A2
SCHEMBL16144424 0.83 NCF1 (0.36) CYP1A2
SCHEMBL15250354 0.83 CYP1A2 (0.32) CYP1A2
SCHEMBL16144433 0.82 CYP1A2 (0.34) CYP1A2PTGDR2
SCHEMBL16144455 0.82 MET (0.31) MET
SCHEMBL16144396 0.81 ABCG2 (0.35) CYP1A2PTGDR2
SCHEMBL16144438 0.81 RAB9A (0.33) METNPC1

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