SCHEMBL16144398

SCHEMBL16144398

c1ccc(N(c2ccccc2)c2ccc3ccc4c(N(c5ccc6ccccc6c5)c5ccccn5)ccc5ccc2c3c54)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.34
HTT P42858 3/20 0.34
NPSR1 Q6W5P4 3/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
ALDH1A1 P00352 2/20 0.34
TSHR P16473 1/20 0.34
HTR1A P08908 2/20 0.32
DRD4 P21917 2/20 0.32
HDAC6 Q9UBN7 2/20 0.32
KDM4E B2RXH2 2/20 0.32
MAPT P10636 2/20 0.32
OPRK1 P41145 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
NPC1 O15118 1/20 0.32
POLB P06746 1/20 0.32
HSP90AA1 P07900 1/20 0.32
HPGD P15428 1/20 0.32
ALOX12 P18054 1/20 0.32
PKM P14618 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
SCHEMBL13321001 0.95 LMNA (0.34) LMNAHTTNPSR1L3MBTL1ALDH1A1
SCHEMBL18558007 0.94 ALDH1A1 (0.39) LMNAHTTNPSR1L3MBTL1ALDH1A1
SCHEMBL16144461 0.92 HTR1A (0.31) LMNAHTTNPSR1L3MBTL1ALDH1A1
SCHEMBL16144459 0.92 HDAC6 (0.32) LMNAHTTNPSR1L3MBTL1ALDH1A1
SCHEMBL16144496 0.91 HTT (0.33) LMNAHTTNPSR1L3MBTL1ALDH1A1
SCHEMBL16144421 0.91 MAOA (0.34) LMNAHTTNPSR1L3MBTL1ALDH1A1
SCHEMBL16144483 0.90 ALDH1A1 (0.31) LMNAHTTNPSR1L3MBTL1ALDH1A1
SCHEMBL13320960 0.89 MAOA (0.35) LMNAHTTNPSR1L3MBTL1ALDH1A1
SCHEMBL2837145 0.89 MAOA (0.35) LMNAHTTNPSR1L3MBTL1ALDH1A1
SCHEMBL15250351 0.88 KDM4E (0.30) LMNAHTTNPSR1L3MBTL1ALDH1A1

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