SCHEMBL16231279

SCHEMBL16231279

c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cc(-c5cncnc5)cc(-c5ccc6c7ccccc7c7ccccc7c6c5)c4)ccc32)cc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 2/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ PTGER4 P35408 1/20 0.35
▸ NPY5R Q15761 2/20 0.34
▸ HDAC8 Q9BY41 2/20 0.33
▸ DRD2 P14416 2/20 0.32
▸ TSPO P30536 1/20 0.32
▸ HDAC4 P56524 1/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ IL1R1 P14778 1/20 0.32
▸ HTR1B P28222 1/20 0.31
▸ HTR6 P50406 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ DHFR P00374 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
SCHEMBL24493239 0.91 ATM (0.49) ATML3MBTL1KDM4EPTGER4NPY5R
SCHEMBL24492899 0.89 ATM (0.46) ATML3MBTL1KDM4EPTGER4NPY5R
SCHEMBL17231564 0.87 L3MBTL1 (0.60) ATML3MBTL1KDM4EPTGER4TSPO
SCHEMBL17231576 0.87 L3MBTL1 (0.60) ATML3MBTL1KDM4EPTGER4TSPO
SCHEMBL15034658 0.86 L3MBTL1 (0.46) ATML3MBTL1KDM4EPTGER4NPY5R
SCHEMBL17227984 0.85 L3MBTL1 (0.55) ATML3MBTL1KDM4EPTGER4NPY5R
SCHEMBL10042913 0.85 L3MBTL1 (0.62) ATML3MBTL1KDM4EPTGER4TSPO
SCHEMBL21249242 0.84 L3MBTL1 (0.53) ATML3MBTL1KDM4EPTGER4NPY5R
SCHEMBL19269843 0.84 ATM (0.41) ATML3MBTL1KDM4ENPY5RHDAC8
SCHEMBL24493054 0.84 ATM (0.44) ATML3MBTL1KDM4EDHFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140336392-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM & HAAS ELECT MAT (KR) 2014-11-13 — — US disclosed
US-20140336392-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM & HAAS ELECT MAT (KR) 2014-11-13 — — US disclosed
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