SCHEMBL16469766

SCHEMBL16469766

Fc1ccccc1Nc1ccc(-c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.50
AURKA O14965 3/20 0.46
MAPK10 P53779 1/20 0.44
AKR1C3 P42330 1/20 0.44
TDP1 Q9NUW8 2/20 0.43
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 2/20 0.43
GAA P10253 2/20 0.43
MAPT P10636 2/20 0.43
KMT2A Q03164 2/20 0.43
GLA P06280 1/20 0.43
RECQL P46063 1/20 0.43
CXCL8 P10145 1/20 0.43
ALDH1A1 P00352 2/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
ALOX12 P18054 1/20 0.42
PTGS1 P23219 1/20 0.42
SLC6A2 P23975 1/20 0.42
MAPK1 P28482 1/20 0.42

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
SCHEMBL22923289 0.96 MAPK10 (0.47) DGAT1AURKAMAPK10TDP1KDM4E
SCHEMBL30785818 0.87 MAPT (0.56) AURKAMAPK10TDP1KDM4EMEN1
SCHEMBL1704615 0.87 MAPT (0.56) AURKAMAPK10TDP1KDM4EMEN1
SCHEMBL1712844 0.84 ALDH1A1 (0.52) AKR1C3TDP1KDM4EMEN1GAA
SCHEMBL11178333 0.83 SMN1; SMN2 (0.56) AURKAMAPK10TDP1KDM4EMEN1
SCHEMBL27811369 0.82 SIRT2 (0.55) DGAT1AURKAMAPK10AKR1C3TDP1
SCHEMBL1713049 0.82 ALDH1A1 (0.57) AKR1C3TDP1KDM4EMEN1GAA
SCHEMBL24287394 0.81 SOS1 (0.55) KDM4EMEN1GAAMAPTKMT2A
SCHEMBL3371377 0.79 MAPT (0.60) AURKATDP1MEN1GAAMAPT
SCHEMBL15145311 0.79 MEN1 (0.51) AURKATDP1KDM4EMEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9564601-B2 Condensed-cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-07 US disclosed
US-20150048323-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-02-19 US disclosed