SCHEMBL10042900

SCHEMBL10042900

CCCCc1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSPO P30536 4/20 0.46
HSD11B1 P28845 2/20 0.42
EP300 Q09472 1/20 0.41
KAT2A Q92830 1/20 0.41
KAT2B Q92831 1/20 0.41
KDM4E B2RXH2 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ATM Q13315 1/20 0.41
DHODH Q02127 1/20 0.38
CTSV O60911 1/20 0.37
CTSL P07711 1/20 0.37
ICMT O60725 1/20 0.37
PTGER4 P35408 1/20 0.37
RARB P10826 1/20 0.36
PLA2G4A P47712 1/20 0.36
IL1R1 P14778 1/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP1A2 P05177 1/20 0.36
GLA P06280 1/20 0.36
CYP3A4 P08684 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
SCHEMBL20005862 1.00 TSPO (0.46) TSPOHSD11B1EP300KAT2AKAT2B
SCHEMBL24004283 0.95 KDM4E (0.41) TSPOHSD11B1EP300KAT2AKAT2B
SCHEMBL11887556 0.93 TSPO (0.45) TSPOHSD11B1EP300KAT2AKAT2B
SCHEMBL18231556 0.92 TSPO (0.41) TSPOHSD11B1EP300KAT2AKAT2B
SCHEMBL20005809 0.92 HSD11B1 (0.47) TSPOHSD11B1EP300KAT2AKAT2B
SCHEMBL11887552 0.92 L3MBTL1 (0.46) TSPOKDM4EL3MBTL1ATMPTGER4
SCHEMBL25785321 0.91 TSPO (0.42) TSPOHSD11B1EP300KAT2AKAT2B
SCHEMBL24004264 0.91 RORA (0.41) TSPOHSD11B1EP300KAT2AKAT2B
SCHEMBL25810829 0.91 TSPO (0.45) TSPOHSD11B1EP300KAT2AKAT2B
SCHEMBL25810727 0.91 EP300 (0.45) TSPOHSD11B1EP300KAT2AKAT2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120037889-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT, DISPLAY DEVICE AND ILLUMINATION DEVICE KONICA MINOLTA HOLDINGS, INC. (JP) 2012-02-16 US disclosed