SCHEMBL12679792

SCHEMBL12679792

N#Cc1c(-c2cccc(-c3ccccc3)c2)c(C(F)(F)F)cc(C(F)(F)F)c1-c1cccc(-c2ccccc2)c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.48
ALDH1A1 P00352 6/20 0.48
HPGD P15428 5/20 0.48
GAA P10253 3/20 0.48
GLA P06280 2/20 0.48
L3MBTL1 Q9Y468 4/20 0.45
TDP1 Q9NUW8 3/20 0.45
KIF11 P52732 1/20 0.44
AR P10275 9/20 0.43
PGR P06401 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL12679791 0.90 KDM4E (0.53) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL14134332 0.90 KDM4E (0.46) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL12681337 0.82 ALDH1A1 (0.43) KDM4EALDH1A1HPGDL3MBTL1HTT
SCHEMBL12679794 0.81 ALDH1A1 (0.48) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL14133890 0.79 ALDH1A1 (0.50) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL24749451 0.76 KDM4E (0.56) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL14148807 0.73 CTSS (0.55) KDM4EALDH1A1GAATDP1MAPT
SCHEMBL25983810 0.72 KDM4E (0.52) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL14134327 0.72 AR (0.47) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL29914887 0.71 CYP11B1 (0.46) KDM4EALDH1A1HPGDGAAGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120298980-A1 ORGANIC ELECTROLUMINESCENT DEVICE UDC IRELAND LIMITED (IE) 2012-11-29 US disclosed
US-8273467-B2 Organic electroluminescent device FUJIFILM CORPORATION (JP) 2012-09-25 US disclosed
US-8273467-B2 Organic electroluminescent device FUJIFILM CORPORATION (JP) 2012-09-25 US disclosed
US-20070202358-A1 Organic electroluminescent device FUJIFILM CORPORATION (JP) 2007-08-30 US disclosed
US-20070202358-A1 Organic electroluminescent device FUJIFILM CORPORATION (JP) 2007-08-30 US disclosed