SCHEMBL2733775

SCHEMBL2733775

c1ccc(-c2c(-c3cccnc3)cc(-c3ccc4c(ccc5ccccc54)c3)c3c2-c2cccc4cccc-3c24)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 11/20 0.51
CYP3A4 P08684 3/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2D6 P10635 1/20 0.45
HSD17B1 P14061 1/20 0.45
CYP2B6 P20813 1/20 0.45
CYP2C19 P33261 1/20 0.45
HSD17B2 P37059 1/20 0.45
GPR84 Q9NQS5 1/20 0.44
CYP11B2 P19099 10/20 0.44
CYP19A1 P11511 4/20 0.44
CYP17A1 P05093 3/20 0.44
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TNF P01375 1/20 0.40

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
SCHEMBL2734539 0.88 CYP11B1 (0.49) CYP11B1CYP3A4CYP2C9GPR84CYP11B2
SCHEMBL2734079 0.88 CYP11B1 (0.49) CYP11B1CYP3A4CYP1A2GPR84CYP11B2
SCHEMBL251545 0.87 CYP11B1 (0.48) CYP11B1CYP3A4CYP1A2GPR84CYP11B2
SCHEMBL16658470 0.84 CYP11B1 (0.48) CYP11B1CYP3A4CYP1A2GPR84CYP11B2
SCHEMBL2733773 0.84 CYP11B1 (0.41) CYP11B1GPR84CYP11B2CYP19A1CYP17A1
SCHEMBL2734542 0.83 CYP11B1 (0.51) CYP11B1CYP3A4CYP1A2CYP2C9GPR84
SCHEMBL16658473 0.83 CYP11B1 (0.47) CYP11B1CYP3A4CYP1A2CYP2C9GPR84
SCHEMBL2734074 0.81 CYP19A1 (0.44) CYP11B1GPR84CYP11B2CYP19A1CYP17A1
SCHEMBL12731981 0.81 KDM4E (0.46) CYP11B1CYP3A4CYP2C9CYP2D6GPR84
SCHEMBL21250811 0.81 CYP11B1 (0.54) CYP11B1CYP3A4CYP1A2CYP2C9CYP2D6

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