SCHEMBL2733768

SCHEMBL2733768

c1ccc(-c2c(-c3cccnc3)c(-c3ccccc3)c3c(c2-c2ccccc2)-c2cccc4cccc-3c24)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.47
CYP11B1 P15538 4/20 0.46
CYP11B2 P19099 3/20 0.46
MAPT P10636 4/20 0.45
ALDH1A1 P00352 4/20 0.45
CYP2A6 P11509 2/20 0.45
GAA P10253 1/20 0.45
MAPK1 P28482 1/20 0.45
HTT P42858 1/20 0.45
HSD17B10 Q99714 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP19A1 P11511 3/20 0.45
CYP17A1 P05093 1/20 0.45
KDM4E B2RXH2 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
HPGD P15428 2/20 0.44
RAB9A P51151 2/20 0.44
PDK2 Q15119 1/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL2734768 1.00 TNF (0.47) TNFCYP11B1CYP11B2MAPTALDH1A1
SCHEMBL2734568 0.93 RXFP1 (0.43) TNFCYP11B1CYP11B2MAPTALDH1A1
SCHEMBL23075856 0.91 CYP11B1 (0.51) TNFCYP11B1CYP11B2MAPTALDH1A1
SCHEMBL2734079 0.88 CYP11B1 (0.49) TNFCYP11B1CYP11B2MAPTALDH1A1
SCHEMBL18058477 0.86 TNF (0.42) TNFCYP11B1CYP11B2MAPTALDH1A1
SCHEMBL251545 0.86 CYP11B1 (0.48) TNFCYP11B1CYP11B2MAPTALDH1A1
SCHEMBL12731986 0.84 KDM4E (0.46) TNFCYP11B1CYP11B2MAPTALDH1A1
SCHEMBL16658470 0.84 CYP11B1 (0.48) TNFCYP11B1CYP11B2MAPTALDH1A1
SCHEMBL728324 0.84 ALDH1A1 (0.56) TNFMAPTALDH1A1GAAMAPK1
SCHEMBL16658473 0.83 CYP11B1 (0.47) TNFCYP11B1CYP11B2MAPTALDH1A1

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