SCHEMBL16200750

SCHEMBL16200750

c1ccc(-n2c3ccccc3c3cc4c(ccc5cc(-c6ccc7ccc8cccc9ccc6c7c89)ccc54)cc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ATM Q13315 1/20 0.42
CYP1A2 P05177 3/20 0.41
ERBB2 P04626 1/20 0.41
FYN P06241 1/20 0.41
MAOA P21397 1/20 0.41
ACHE P22303 1/20 0.41
AHR P35869 1/20 0.41
SIGMAR1 Q99720 1/20 0.32
ALDH1A1 P00352 4/20 0.31
HSD17B10 Q99714 4/20 0.31
HPGD P15428 3/20 0.31
HIF1A Q16665 2/20 0.31
CYP1B1 Q16678 1/20 0.31
THRB P10828 1/20 0.31
HSD17B1 P14061 1/20 0.30
HSD17B2 P37059 1/20 0.30
HDAC4 P56524 1/20 0.30
GPR84 Q9NQS5 1/20 0.30

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
SCHEMBL12716557 0.90 L3MBTL1 (0.49) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL21190613 0.89 L3MBTL1 (0.47) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL16200712 0.89 L3MBTL1 (0.40) L3MBTL1KDM4EATMALDH1A1HSD17B10
SCHEMBL13417862 0.87 KDM4E (0.43) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL16302957 0.87 L3MBTL1 (0.45) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL16557795 0.87 L3MBTL1 (0.47) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL21190610 0.87 L3MBTL1 (0.37) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL23109469 0.86 L3MBTL1 (0.41) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL21190467 0.86 L3MBTL1 (0.53) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL21190540 0.85 L3MBTL1 (0.36) L3MBTL1KDM4EATMCYP1A2ERBB2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9748490-B2 Organic compound, organic light-emitting element, and image display unit CANON KABUSHIKI KAISHA (JP) 2017-08-29 US disclosed
US-9748490-B2 Organic compound, organic light-emitting element, and image display unit CANON KABUSHIKI KAISHA (JP) 2017-08-29 US disclosed
EP-2799429-A1 Novel organic compound, organic light-emitting element, and image display unit Canon Kabushiki Kaisha (JP) 2014-11-05 EP disclosed
US-20140319494-A1 NOVEL ORGANIC COMPOUND, ORGANIC LIGHT-EMITTING ELEMENT, AND IMAGE DISPLAY UNIT CANON KABUSHIKI KAISHA (JP) 2014-10-30 US disclosed
US-20140319494-A1 NOVEL ORGANIC COMPOUND, ORGANIC LIGHT-EMITTING ELEMENT, AND IMAGE DISPLAY UNIT CANON KABUSHIKI KAISHA (JP) 2014-10-30 US disclosed