SCHEMBL2734074

SCHEMBL2734074

c1ccc(-c2cc3c4c(cccc4c2)-c2c(-c4ccccc4)cc(-c4cccnc4)c(-c4ccccc4)c2-3)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 4/20 0.44
CYP11B1 P15538 6/20 0.43
CYP11B2 P19099 5/20 0.41
CYP17A1 P05093 1/20 0.41
TNF P01375 1/20 0.40
PDK2 Q15119 2/20 0.40
GPR84 Q9NQS5 1/20 0.39
KDM4E B2RXH2 3/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CYP2A6 P11509 1/20 0.39
KMO O15229 1/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
POLB P06746 1/20 0.39
TSHR P16473 1/20 0.39
PTGS2 P35354 1/20 0.36
ALOX5 P09917 1/20 0.36
HPGD P15428 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
SCHEMBL2733771 0.92 CYP19A1 (0.49) CYP19A1CYP11B1CYP11B2CYP17A1PDK2
SCHEMBL251545 0.91 CYP11B1 (0.48) CYP19A1CYP11B1CYP11B2CYP17A1TNF
SCHEMBL2734079 0.90 CYP11B1 (0.49) CYP19A1CYP11B1CYP11B2CYP17A1TNF
SCHEMBL16658470 0.88 CYP11B1 (0.48) CYP19A1CYP11B1CYP11B2CYP17A1TNF
SCHEMBL16658475 0.87 CYP11B1 (0.43) CYP19A1CYP11B1CYP11B2CYP17A1TNF
SCHEMBL16658473 0.85 CYP11B1 (0.47) CYP19A1CYP11B1CYP11B2CYP17A1TNF
SCHEMBL2734539 0.82 CYP11B1 (0.49) CYP19A1CYP11B1CYP11B2CYP17A1TNF
SCHEMBL2733775 0.81 CYP11B1 (0.51) CYP19A1CYP11B1CYP11B2CYP17A1TNF
SCHEMBL12731981 0.80 KDM4E (0.46) CYP19A1CYP11B1CYP11B2CYP17A1PDK2
SCHEMBL2734065 0.80 ATM (0.43) CYP11B1CYP11B2TNFPDK2L3MBTL1

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-8088500-B2 OLED device with fluoranthene electron injection materials GLOBAL OLED TECHNOLOGY LLC (US) 2012-01-03 US disclosed
US-8088500-B2 OLED device with fluoranthene electron injection materials GLOBAL OLED TECHNOLOGY LLC (US) 2012-01-03 US disclosed
US-20100117520-A1 OLED DEVICE WITH FLUORANTHENE ELECTRON INJECTION MATERIALS GLOBAL OLED TECHNOLOGY LLC 2010-05-13 US disclosed
US-20100117520-A1 OLED DEVICE WITH FLUORANTHENE ELECTRON INJECTION MATERIALS GLOBAL OLED TECHNOLOGY LLC 2010-05-13 US disclosed