SCHEMBL30130262

SCHEMBL30130262

O=S(=O)(O)c1c(OCC(F)F)cccc1C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 4/20 0.36
SLC22A12 Q96S37 1/20 0.36
PPARG P37231 2/20 0.35
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 1/20 0.35
SCN1A P35498 1/20 0.33
SCN5A Q14524 1/20 0.33
SCN9A Q15858 1/20 0.33
KCNK3 O14649 1/20 0.33
KCNK9 Q9NPC2 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ENPP2 Q13822 1/20 0.32
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 1/20 0.31
NOTUM Q6P988 1/20 0.31
MGLL Q99685 1/20 0.31
ABHD6 Q9BV23 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL29115260 0.86 SLC22A12 (0.36) MRGPRX4SLC22A12PPARGRXRARXRB
SCHEMBL4394385 0.86 SLC22A12 (0.36) MRGPRX4SLC22A12PPARGRXRARXRB
SCHEMBL29431092 0.86 SLC22A12 (0.36) MRGPRX4SLC22A12PPARGRXRARXRB
SCHEMBL30839044 0.86 SLC22A12 (0.36) MRGPRX4SLC22A12PPARGRXRARXRB
SCHEMBL31037153 0.84 SLC22A12 (0.35) MRGPRX4SLC22A12PPARGRXRARXRB
SCHEMBL28046559 0.78 RXRA (0.43) MRGPRX4SLC22A12PPARGRXRARXRB
SCHEMBL795355 0.78 MEN1 (0.41) SLC22A12MEN1KMT2A
SCHEMBL31037148 0.77 MRGPRX4 (0.37) MRGPRX4PPARGRXRARXRBRXRG
SCHEMBL31037150 0.77 MRGPRX4 (0.37) MRGPRX4PPARGRXRARXRBRXRG
SCHEMBL28219895 0.76 RXRA (0.46) MRGPRX4SLC22A12PPARGRXRARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118459382-A Synthesis method of sulfhydryl phenyl ether compound 上海泰初化工技术有限公司 2024-08-09 CN claimed
CN-115490622-A Trifluoromethyl thiophenol compound 上海泰初化工技术有限公司 2022-12-20 CN claimed
CN-118459382-A Synthesis method of sulfhydryl phenyl ether compound 上海泰初化工技术有限公司 2024-08-09 CN disclosed
CN-115490622-A Trifluoromethyl thiophenol compound 上海泰初化工技术有限公司 2022-12-20 CN disclosed