SCHEMBL17950229

SCHEMBL17950229

FC(F)(F)c1ccc(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)c(C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 3/20 0.46
▸ DHODH Q02127 1/20 0.38
▸ GLO1 Q04760 1/20 0.37
▸ DGAT1 O75907 1/20 0.37
▸ KCNH2 Q12809 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ LDHA P00338 1/20 0.36
▸ CYP2C9 P11712 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ BACE1 P56817 1/20 0.35
▸ HSP90AA1 P07900 1/20 0.34
▸ HCAR1 Q9BXC0 1/20 0.34
▸ PPARG P37231 2/20 0.34
▸ MAOB P27338 1/20 0.34
▸ AGXT P21549 1/20 0.34

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
SCHEMBL17950236 0.89 KIF11 (0.46) KIF11DHODHGLO1DGAT1KCNH2
SCHEMBL18374182 0.89 KIF11 (0.49) KIF11DHODHGLO1DGAT1KCNH2
SCHEMBL22140545 0.87 KIF11 (0.40) KIF11GLO1LDHA
SCHEMBL20364454 0.86 KIF11 (0.46) KIF11DHODHGLO1DGAT1KCNH2
SCHEMBL17950233 0.86 PIK3CA (0.40) KIF11LDHAHCAR1PPARG
SCHEMBL17950224 0.86 KIF11 (0.46) KIF11DHODHGLO1DGAT1KCNH2
SCHEMBL17950225 0.83 KIF11 (0.46) KIF11DHODHGLO1DGAT1KCNH2
SCHEMBL26534937 0.83 KIF11 (0.42) KIF11DHODHGLO1ALDH1A1MAPT
SCHEMBL26529151 0.83 LDHA (0.40) KIF11GLO1ALDH1A1MAPTLDHA
SCHEMBL26529084 0.83 LDHA (0.40) KIF11GLO1ALDH1A1MAPTLDHA

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-10669473-B2 Organic molecules for use in optoelectronic components CYNORA GMBH (DE) 2020-06-02 — — US disclosed
WO-2016116497-A1 ORGANIC MOLECULES, IN PARTICULAR, FOR USE IN OPTOELECTRONIC COMPONENTS CYNORA GMBH (DE) 2016-07-28 — — WO disclosed
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