SCHEMBL29765367

SCHEMBL29765367

Fc1cc(C=Cc2ccc(-c3ccc(C=Cc4ccc(-n5c6ccccc6c6ccccc65)c(F)c4)cc3)cc2)ccc1-n1c2ccccc2c2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.37
NFE2L2 Q16236 10/20 0.37
KDM4E B2RXH2 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ALDH1A1 P00352 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
MITF O75030 1/20 0.33
HSP90AA1 P07900 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
PABPC1 P11940 1/20 0.33
RAB9A P51151 1/20 0.33
EIF4H Q15056 1/20 0.33
CYP17A1 P05093 1/20 0.33
CYP21A2 P08686 1/20 0.33
CYP11B1 P15538 1/20 0.33
GLA P06280 1/20 0.32

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
SCHEMBL28769849 1.00 LMNA (0.37) LMNANFE2L2KDM4EATML3MBTL1
SCHEMBL29765536 0.83 CYP17A1 (0.36) LMNANFE2L2KDM4EATML3MBTL1
SCHEMBL28943680 0.83 CYP17A1 (0.36) LMNANFE2L2KDM4EATML3MBTL1
SCHEMBL13866720 0.82 L3MBTL1 (0.42) KDM4EATML3MBTL1ALDH1A1MAPT
SCHEMBL29765436 0.81 ALDH1A1 (0.51) KDM4EATML3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL28769168 0.81 ALDH1A1 (0.51) KDM4EATML3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL28769176 0.79 NFE2L2 (0.35) LMNANFE2L2KDM4EATML3MBTL1
SCHEMBL29765541 0.79 NFE2L2 (0.35) LMNANFE2L2KDM4EATML3MBTL1
SCHEMBL28769163 0.78 KDM4E (0.42) NFE2L2KDM4EATML3MBTL1
SCHEMBL28769940 0.78 NFE2L2 (0.41) LMNANFE2L2KDM4EATML3MBTL1

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
CN-114685358-A Fluorine-containing organic blue light material, preparation method and application thereof 中国科学院福建物质结构研究所 2022-07-01 CN disclosed