SCHEMBL17950241

SCHEMBL17950241

Fc1ccc(F)c(-n2c3ccc(-n4c5ccccc5c5ccccc54)cc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ ATM Q13315 2/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ JAK2 O60674 1/20 0.37
▸ JAK3 P52333 1/20 0.37
▸ CYP1A2 P05177 2/20 0.36
▸ METAP2 P50579 2/20 0.36
▸ GLA P06280 1/20 0.35
▸ ALDH1A1 P00352 4/20 0.34
▸ MPI P34949 1/20 0.32
▸ USP14 P54578 1/20 0.32
▸ ESR1 P03372 1/20 0.31
▸ HTT P42858 2/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

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
SCHEMBL17950239 0.91 GLA (0.43) L3MBTL1ATMKDM4EJAK2JAK3
SCHEMBL17950300 0.89 L3MBTL1 (0.50) L3MBTL1ATMKDM4EJAK2JAK3
SCHEMBL26127570 0.87 KDM4E (0.47) L3MBTL1ATMKDM4EALDH1A1HTT
SCHEMBL29379 0.84 ATM (0.55) L3MBTL1ATMKDM4EJAK2JAK3
SCHEMBL17950244 0.83 ATM (0.38) L3MBTL1ATMKDM4EJAK2JAK3
SCHEMBL17950247 0.83 KIF11 (0.44) L3MBTL1ATMKDM4ECYP1A2MPI
SCHEMBL8739922 0.83 ATM (0.60) L3MBTL1ATMKDM4EJAK2JAK3
SCHEMBL14407589 0.81 KDM4E (0.47) L3MBTL1ATMKDM4EJAK2JAK3
SCHEMBL25222460 0.81 KDM4E (0.41) L3MBTL1ATMKDM4EALDH1A1
SCHEMBL17950243 0.80 ATM (0.38) L3MBTL1ATMKDM4EJAK2JAK3

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
WO-2016116497-A1 ORGANIC MOLECULES, IN PARTICULAR, FOR USE IN OPTOELECTRONIC COMPONENTS CYNORA GMBH (DE) 2016-07-28 — — WO disclosed
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