SCHEMBL16144459

SCHEMBL16144459

C[Si](C)(C)c1ccc(N(c2ccccc2)c2ccc3ccc4c(N(c5ccc6ccccc6c5)c5ccccn5)ccc5ccc2c3c54)cc1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
TSHR P16473 1/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL16144494 0.93 HDAC6 (0.34) HDAC6ALDH1A1
SCHEMBL16144398 0.92 LMNA (0.34) HDAC6ALDH1A1LMNATSHRHTT
SCHEMBL18558007 0.89 ALDH1A1 (0.39) HDAC6ALDH1A1LMNATSHRHTT
SCHEMBL13321001 0.88 LMNA (0.34) ALDH1A1LMNATSHRHTTNPSR1
SCHEMBL16144461 0.85 HTR1A (0.31) ALDH1A1LMNATSHRHTTNPSR1
SCHEMBL16144496 0.84 HTT (0.33) ALDH1A1LMNATSHRHTTNPSR1
SCHEMBL16144421 0.84 MAOA (0.34) HDAC6ALDH1A1LMNATSHRHTT
SCHEMBL16144460 0.84 CYP1A2 (0.31)
SCHEMBL16144483 0.83 ALDH1A1 (0.31) ALDH1A1LMNATSHRHTTNPSR1
SCHEMBL16144412 0.83 HDAC6 (0.33) HDAC6ALDH1A1

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