SCHEMBL6128502

SCHEMBL6128502

O=C(c1ccccc1)c1cc2c3c(c1)c1ccccc1c1cccc(c13)C21c2ccccc2-c2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 6/20 0.45
▸ TDP1 Q9NUW8 2/20 0.41
▸ ATM Q13315 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.38
▸ PBRM1 Q86U86 1/20 0.36
▸ THRB P10828 1/20 0.35
▸ SRD5A2 P31213 1/20 0.34
▸ ALOX5 P09917 1/20 0.34
▸ PTGS1 P23219 1/20 0.34
▸ PTGS2 P35354 1/20 0.34
▸ GABRA1 P14867 1/20 0.33
▸ GABRB1 P18505 1/20 0.33
▸ CNR1 P21554 1/20 0.33
▸ CNR2 P34972 1/20 0.33

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
SCHEMBL15199493 0.91 PDK2 (0.39) PDK2TDP1ATML3MBTL1PBRM1
SCHEMBL6128490 0.89 PDK2 (0.48) PDK2TDP1ATML3MBTL1ALDH1A1
SCHEMBL10052642 0.89 PDK2 (0.54) PDK2TDP1ATML3MBTL1ALDH1A1
SCHEMBL10052600 0.89 PDK2 (0.42) PDK2CNR1CNR2
SCHEMBL6128516 0.86 PDK2 (0.48) PDK2TDP1ATML3MBTL1ALDH1A1
SCHEMBL10052641 0.82 PDK2 (0.44) PDK2TDP1ATML3MBTL1PBRM1
SCHEMBL6128488 0.82 PDK2 (0.44) PDK2TDP1ATML3MBTL1PBRM1
SCHEMBL10052592 0.79 PDK2 (0.42) PDK2TDP1ATML3MBTL1CNR1
SCHEMBL10052595 0.79 PDK2 (0.40) PDK2TDP1ATML3MBTL1PBRM1
SCHEMBL15200473 0.79 ATM (0.59) TDP1ATML3MBTL1ALDH1A1PBRM1

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-9991450-B2 Spiro[cyclopenta[def]triphenylene-4,9′-fluorene] compound and organic light-emitting device having the same CANON KABUSHIKI KAISHA (JP) 2018-06-05 — — US disclosed
US-9991450-B2 Spiro[cyclopenta[def]triphenylene-4,9′-fluorene] compound and organic light-emitting device having the same CANON KABUSHIKI KAISHA (JP) 2018-06-05 — — US disclosed
US-20130214267-A1 SPIRO[CYCLOPENTA[def]TRIPHENYLENE-4,9'-FLUORENE] COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE HAVING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-08-22 — — US disclosed
WO-2012056919-A1 SPIRO[CYCLOPENTA[def]TRIPHENYLENE-4,9'-FLUORENE] COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE HAVING THE SAME CANON KABUSHIKI KAISHA (JP) 2012-05-03 — — WO disclosed
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