SCHEMBL12731986

SCHEMBL12731986

c1ccc(-c2c(-c3cccnc3)c(-c3cnc4c(ccc5cccnc54)c3)c(-c3ccccc3)c3c2-c2cccc4cccc-3c24)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
CYP2A6 P11509 1/20 0.43
CYP11B1 P15538 4/20 0.43
CYP11B2 P19099 3/20 0.43
CYP19A1 P11511 3/20 0.43
CYP17A1 P05093 1/20 0.43
CCR1 P32246 2/20 0.42
CCR5 P51681 2/20 0.42
CCR8 P51685 2/20 0.42
MAPT P10636 2/20 0.38
HTT P42858 2/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP2C9 P11712 2/20 0.38

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
SCHEMBL12731993 0.94 CCR1 (0.47) KDM4EL3MBTL1NPC1RAB9ACYP2A6
SCHEMBL12731981 0.90 KDM4E (0.46) KDM4EL3MBTL1NPC1RAB9ACYP2A6
SCHEMBL2734768 0.84 TNF (0.47) KDM4ENPC1RAB9ACYP2A6CYP11B1
SCHEMBL2733768 0.84 TNF (0.47) KDM4ENPC1RAB9ACYP2A6CYP11B1
SCHEMBL12731968 0.84 CCR1 (0.43) KDM4EL3MBTL1NPC1RAB9ACCR1
SCHEMBL23075856 0.79 CYP11B1 (0.51) KDM4ENPC1RAB9ACYP2A6CYP11B1
SCHEMBL2734568 0.78 RXFP1 (0.43) KDM4EL3MBTL1NPC1RAB9ACYP2A6
SCHEMBL2734550 0.77 KDM4E (0.46) KDM4EL3MBTL1ALDH1A1HPGDTP53
SCHEMBL2734079 0.77 CYP11B1 (0.49) KDM4ERAB9ACYP2A6CYP11B1CYP11B2
SCHEMBL12731982 0.76 CCR1 (0.42) KDM4ECYP11B1CYP11B2CYP19A1CYP17A1

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-7931975-B2 Electroluminescent device containing a flouranthene compound GLOBAL OLED TECHNOLOGY LLC (US) 2011-04-26 US disclosed
US-7931975-B2 Electroluminescent device containing a flouranthene compound GLOBAL OLED TECHNOLOGY LLC (US) 2011-04-26 US disclosed
US-20100117519-A1 ELECTROLUMINESCENT DEVICE CONTAINING A FLOURANTHENE COMPOUND GLOBAL OLED TECHNOLOGY LLC 2010-05-13 US disclosed
US-20100117519-A1 ELECTROLUMINESCENT DEVICE CONTAINING A FLOURANTHENE COMPOUND GLOBAL OLED TECHNOLOGY LLC 2010-05-13 US disclosed