SCHEMBL28822896

SCHEMBL28822896

Cc1ccc(/C=C/c2nc(-c3ccc(F)cc3)cs2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.60
KDM4E B2RXH2 3/20 0.60
HPGD P15428 1/20 0.60
NFE2L2 Q16236 2/20 0.54
NPSR1 Q6W5P4 1/20 0.48
RAB9A P51151 6/20 0.47
ALOX5 P09917 1/20 0.47
NPC1 O15118 5/20 0.46
AR P10275 2/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
SREBF2 Q12772 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
MAPT P10636 2/20 0.43
GAA P10253 1/20 0.43
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 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
SCHEMBL28822927 0.93 ALDH1A1 (0.67) ALDH1A1KDM4EHPGDNFE2L2RAB9A
SCHEMBL28949043 0.86 ALDH1A1 (0.60) ALDH1A1KDM4EHPGDRAB9AALOX5
SCHEMBL28485223 0.86 KDM1A (0.48) ALDH1A1KDM4EHPGDRAB9ANPC1
SCHEMBL28485222 0.86 KDM1A (0.48) ALDH1A1KDM4EHPGDRAB9ANPC1
SCHEMBL28822861 0.85 ALDH1A1 (0.57) ALDH1A1KDM4EHPGDNPSR1RAB9A
SCHEMBL28822865 0.85 NFE2L2 (0.58) ALDH1A1KDM4EHPGDNFE2L2RAB9A
SCHEMBL28822929 0.84 ALDH1A1 (0.59) ALDH1A1KDM4EHPGDNFE2L2NPSR1
SCHEMBL28822917 0.83 KDM4E (0.58) ALDH1A1KDM4EHPGDNPSR1RAB9A
SCHEMBL28469598 0.79 NFE2L2 (0.45) ALDH1A1KDM4EHPGDNFE2L2NPSR1
SCHEMBL28822897 0.78 ALDH1A1 (0.52) 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