SCHEMBL14099808

SCHEMBL14099808

c1ccc(-c2cccc(N(c3ccccc3)c3ccc4c(-c5ccc6ccc7cccc8ccc5c6c78)c5cc(N(c6ccccc6)c6cccc(-c7ccccc7)c6)ccc5c(-c5ccc6ccccc6c5)c4c3)c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 3/20 0.33
HSD17B2 P37059 3/20 0.33
ESR1 P03372 4/20 0.32
ESR2 Q92731 4/20 0.32
CYP1A2 P05177 3/20 0.31
ERBB2 P04626 1/20 0.31
FYN P06241 1/20 0.31
MAOA P21397 1/20 0.31
ACHE P22303 1/20 0.31
AHR P35869 1/20 0.31
CYP2D6 P10635 2/20 0.31
CYP2C9 P11712 2/20 0.31
CYP2C19 P33261 2/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2B6 P20813 1/20 0.31
TSHR P16473 1/20 0.31
SOS1 Q07889 1/20 0.31
HIF1A Q16665 1/20 0.31
ACMSD Q8TDX5 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
SCHEMBL14099812 0.94 ESR1 (0.33) HSD17B1HSD17B2ESR1ESR2CYP1A2
SCHEMBL14330789 0.92 CYP1A2 (0.36) HSD17B1HSD17B2ESR1ESR2CYP1A2
SCHEMBL12014690 0.91 CYP1A2 (0.37) HSD17B1HSD17B2ESR1ESR2CYP1A2
SCHEMBL12014688 0.88 CYP1A2 (0.37) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL14099825 0.88 HSD17B1 (0.40) HSD17B1HSD17B2ESR1ESR2CYP1A2
SCHEMBL14100085 0.88 ESR1 (0.40) HSD17B1HSD17B2ESR1ESR2CYP1A2
SCHEMBL12322630 0.87 PIM1 (0.35) HSD17B1HSD17B2ESR1ESR2CYP1A2
SCHEMBL12322631 0.87 HSD17B1 (0.37) HSD17B1HSD17B2ESR1ESR2CYP1A2
SCHEMBL22435498 0.87 HSD17B1 (0.41) HSD17B1HSD17B2ESR1ESR2CYP1A2
SCHEMBL12014686 0.87 CYP1A2 (0.40) CYP1A2ERBB2FYNMAOAACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9620721-B2 OLEDs having high efficiency and excellent lifetime GLOBAL OLED TECHNOLOGY LLC (US) 2017-04-11 US disclosed
US-9620721-B2 OLEDs having high efficiency and excellent lifetime GLOBAL OLED TECHNOLOGY LLC (US) 2017-04-11 US disclosed
US-8795855-B2 OLEDs having high efficiency and excellent lifetime GLOBAL OLED TECHNOLOGY LLC (US) 2014-08-05 US disclosed
US-8795855-B2 OLEDs having high efficiency and excellent lifetime GLOBAL OLED TECHNOLOGY LLC (US) 2014-08-05 US disclosed
US-20140151676-A1 OLEDS HAVING HIGH EFFICIENCY AND EXCELLENT LIFETIME GLOBAL OLED TECHNOLOGY LLC (US) 2014-06-05 US disclosed
US-20140151676-A1 OLEDS HAVING HIGH EFFICIENCY AND EXCELLENT LIFETIME GLOBAL OLED TECHNOLOGY LLC (US) 2014-06-05 US disclosed
US-20080182129-A1 OLEDS HAVING HIGH EFFICIENCY AND EXCELLENT LIFETIME GLOBAL OLED TECHNOLOGY LLC 2008-07-31 US disclosed
US-20080182129-A1 OLEDS HAVING HIGH EFFICIENCY AND EXCELLENT LIFETIME GLOBAL OLED TECHNOLOGY LLC 2008-07-31 US disclosed