SCHEMBL28822927

SCHEMBL28822927

Fc1ccc(/C=C/c2nc(-c3ccc(F)cc3)cs2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.67
KDM4E B2RXH2 2/20 0.67
HPGD P15428 1/20 0.67
RAB9A P51151 4/20 0.54
ALOX5 P09917 3/20 0.54
HDAC1 Q13547 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
AR P10275 4/20 0.49
ATP4A P20648 2/20 0.45
ATP4B P51164 2/20 0.45
NPY5R Q15761 1/20 0.44
TP53 P04637 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
NPC1 O15118 3/20 0.42
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
NFE2L2 Q16236 1/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL28949043 0.93 ALDH1A1 (0.60) ALDH1A1KDM4EHPGDRAB9AALOX5
SCHEMBL28822896 0.93 ALDH1A1 (0.60) ALDH1A1KDM4EHPGDRAB9AALOX5
SCHEMBL28822917 0.90 KDM4E (0.58) ALDH1A1KDM4EHPGDRAB9AALOX5
SCHEMBL28822861 0.89 ALDH1A1 (0.57) ALDH1A1KDM4EHPGDRAB9AALOX5
SCHEMBL28822865 0.89 NFE2L2 (0.58) ALDH1A1KDM4EHPGDRAB9AALOX5
SCHEMBL28822929 0.82 ALDH1A1 (0.59) ALDH1A1KDM4EHPGDRAB9AALOX5
SCHEMBL29387676 0.82 ALDH1A1 (0.59) ALDH1A1KDM4EHPGDRAB9AALOX5
SCHEMBL28481152 0.81 ALDH1A1 (0.49) ALDH1A1KDM4EHPGDRAB9AALOX5
SCHEMBL3875666 0.81 ALDH1A1 (0.51) ALDH1A1KDM4EHPGDRAB9AALOX5
SCHEMBL3875669 0.81 ALDH1A1 (0.51) ALDH1A1KDM4EHPGDRAB9AALOX5

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
CN-110372630-B Stilbene analogue containing phenylthiazole structure and synthesis method and application thereof 浙江工业大学 2022-08-19 CN disclosed
CN-110367265-B Application of stilbene analogue containing phenylthiazole structure as bactericide 浙江工业大学 2022-02-15 CN disclosed