SCHEMBL17952918

SCHEMBL17952918

c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cc(-c3ccnc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3)ccn2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.48
ATM Q13315 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
ASIC3 Q9UHC3 1/20 0.39
PTPN1 P18031 1/20 0.38
TGFBR1 P36897 6/20 0.38
MAPT P10636 3/20 0.37
KMT2A Q03164 3/20 0.37
NPSR1 Q6W5P4 3/20 0.37
HTT P42858 3/20 0.37
CYP1A2 P05177 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
POLB P06746 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
THRB P10828 1/20 0.37
PPP1CA P62136 1/20 0.37
HDAC4 P56524 1/20 0.37
LMNA P02545 1/20 0.36

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
SCHEMBL17952894 0.94 KDM4E (0.43) KDM4EATML3MBTL1ASIC3PTPN1
SCHEMBL17952728 0.94 KDM4E (0.43) KDM4EATML3MBTL1ASIC3PTPN1
SCHEMBL19238787 0.94 KDM4E (0.48) KDM4EATML3MBTL1PTPN1MAPT
SCHEMBL15034455 0.93 KDM4E (0.46) KDM4EATML3MBTL1ASIC3PTPN1
SCHEMBL18157086 0.90 KDM4E (0.44) KDM4EATML3MBTL1ASIC3PTPN1
SCHEMBL19238786 0.87 KDM4E (0.50) KDM4EATML3MBTL1PTPN1KMT2A
SCHEMBL19238785 0.87 KDM4E (0.50) KDM4EATML3MBTL1PTPN1MAPT
SCHEMBL19238782 0.86 L3MBTL1 (0.53) KDM4EATML3MBTL1PTPN1MAPT
SCHEMBL19238781 0.86 L3MBTL1 (0.53) KDM4EATML3MBTL1PTPN1MAPT
SCHEMBL17952928 0.86 ASIC3 (0.42) KDM4EATML3MBTL1ASIC3TGFBR1

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-10544361-B2 Pyridines and derivatives thereof as components for use in optoelectronic components CYNORA GMBH (DE) 2020-01-28 US disclosed
WO-2016116517-A1 PYRIDINES AND DERIVATIVES THEREOF AS COMPONENTS FOR USE IN OPTOELECTRONIC COMPONENTS CYNORA GMBH (DE) 2016-07-28 WO disclosed