SCHEMBL10100853

SCHEMBL10100853

c1ccc(-n2c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nnc2-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.64
ATM Q13315 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
AVPR1A P37288 1/20 0.54
HPGD P15428 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
ALDH1A1 P00352 4/20 0.49
HSD17B10 Q99714 3/20 0.49
TSHR P16473 1/20 0.49
GLA P06280 1/20 0.48
KMT2A Q03164 4/20 0.47
MEN1 O00255 2/20 0.47
RXFP1 Q9HBX9 1/20 0.47
OXTR P30559 1/20 0.45
LMNA P02545 1/20 0.44
MAPK1 P28482 1/20 0.44
HDAC4 P56524 1/20 0.43
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41

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
SCHEMBL29622127 0.98 KDM4E (0.62) KDM4EATML3MBTL1AVPR1AHPGD
SCHEMBL888033 0.98 KDM4E (0.62) KDM4EATML3MBTL1AVPR1AHPGD
SCHEMBL10110955 0.97 KDM4E (0.60) KDM4EATML3MBTL1AVPR1AHPGD
SCHEMBL10111058 0.97 KDM4E (0.60) KDM4EATML3MBTL1AVPR1AHPGD
SCHEMBL10111104 0.95 AVPR1A (0.57) KDM4EATML3MBTL1AVPR1AHPGD
SCHEMBL10111013 0.95 AVPR1A (0.57) KDM4EATML3MBTL1AVPR1AHPGD
SCHEMBL2744593 0.95 KDM4E (0.61) KDM4EATML3MBTL1AVPR1AHPGD
SCHEMBL10110942 0.94 KDM4E (0.56) KDM4EATML3MBTL1AVPR1AHPGD
SCHEMBL10110967 0.92 KDM4E (0.57) KDM4EATML3MBTL1AVPR1AHPGD
SCHEMBL18119486 0.92 KDM4E (0.58) KDM4EATML3MBTL1AVPR1AHPGD

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-8178214-B2 Material for organic electroluminescence element, organic electroluminescence element, display device and illumination device KONICA MINOLTA HOLDINGS, INC. (JP) 2012-05-15 US disclosed
US-8178214-B2 Material for organic electroluminescence element, organic electroluminescence element, display device and illumination device KONICA MINOLTA HOLDINGS, INC. (JP) 2012-05-15 US disclosed
US-20070184301-A1 Material for organic electroluminescence element, organic electroluminescence element, display device and illumination device KONICA MINOLTA HOLDINGS, INC. (JP) 2007-08-09 US disclosed
US-20070184301-A1 Material for organic electroluminescence element, organic electroluminescence element, display device and illumination device KONICA MINOLTA HOLDINGS, INC. (JP) 2007-08-09 US disclosed