SCHEMBL29466935

SCHEMBL29466935

F[Sb-](F)(F)(F)(F)F.c1ccc(-c2ccc(S[S+](c3ccccc3)c3ccccc3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.38
ALDH1A1 P00352 2/20 0.35
CYP1A2 P05177 2/20 0.32
MAPK1 P28482 1/20 0.32
CYP3A4 P08684 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MMP3 P08254 1/20 0.32
BCL2L1 Q07817 1/20 0.32
PTPN5 P54829 1/20 0.32
CYP1A1 P04798 1/20 0.31
CYP1B1 Q16678 1/20 0.31
PTGS2 P35354 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
SCHEMBL29535360 0.92 ALDH1A1 (0.41) KIF11ALDH1A1CYP1A2MAPK1CYP3A4
SCHEMBL38652183 0.89 KIF11 (0.38) KIF11ALDH1A1CYP1A2MAPK1CYP3A4
SCHEMBL31412242 0.88 MAPT (0.36) ALDH1A1MAPK1HSD17B10
SCHEMBL31290715 0.79 MAPT (0.43) ALDH1A1MAPK1HSD17B10
SCHEMBL6658830 0.71 MAPT (0.36) ALDH1A1MAPK1HSD17B10
Biphenyl SCHEMBL6763090 0.69 ALDH1A1 (0.50) KIF11ALDH1A1CYP1A2MAPK1CYP3A4
Biphenyl SCHEMBL27668610 0.68 ALDH1A1 (0.64) KIF11ALDH1A1CYP1A2MAPK1CYP3A4
Biphenyl SCHEMBL27588416 0.66 ALDH1A1 (0.60) KIF11ALDH1A1CYP1A2MAPK1CYP3A4
SCHEMBL29962270 0.65 HPGD (0.39) ALDH1A1MAPK1CYP3A4
SCHEMBL30782728 0.65 ALDH1A1 (0.39) ALDH1A1CYP1A2MAPK1CYP3A4TAAR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113072900-B Ultraviolet-curable pressure-sensitive adhesive composition and ultraviolet-curable pressure-sensitive adhesive tape 3M创新有限公司 2022-09-23 CN disclosed
CN-114207083-A Composite pigment, identification medium and authenticity judgment method 日本瑞翁株式会社 2022-03-18 CN disclosed
CN-114207084-A Composite pigment, identification medium and authenticity judgment method 日本瑞翁株式会社 2022-03-18 CN disclosed