SCHEMBL776942

SCHEMBL776942

O=S(=O)(O)Cc1cc(F)cc(F)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.38
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA9 Q16790 1/20 0.36
MMP2 P08253 2/20 0.33
MMP9 P14780 2/20 0.33
AURKA O14965 1/20 0.33
PTPN1 P18031 1/20 0.33
MMP1 P03956 1/20 0.33
MMP12 P39900 1/20 0.33
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
DAO P14920 1/20 0.32
MMP14 P50281 1/20 0.32
ADAM17 P78536 1/20 0.32
S100A9 P06702 1/20 0.32
NR3C1 P04150 1/20 0.32
PGR P06401 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
SCHEMBL24407435 0.82 SLC22A12 (0.31) CA1MMP2MMP9MMP1
SCHEMBL777783 0.80 TAAR1 (0.48) IDO1DAO
SCHEMBL3300930 0.80 IDO1 (0.41) IDO1CES2CES1CA12CA1
SCHEMBL778663 0.77 DAO (0.38) IDO1CES2CES1CA12CA1
SCHEMBL9394710 0.76 IDO1 (0.38) IDO1CES2CES1CA12CA1
SCHEMBL17459471 0.76 CA1 (0.48) IDO1CES2CES1CA12CA1
SCHEMBL776965 0.76 LOXL2 (0.48) IDO1CA1MMP2MMP9MMP1
SCHEMBL3297054 0.76 IDO1 (0.38) IDO1CES2CES1CA12CA1
SCHEMBL16914868 0.76 MMP2 (0.53) IDO1CES2CES1CA1MMP2
SCHEMBL18793473 0.74 NR3C1 (0.37) IDO1CES2CES1CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115043844-B TRK kinase inhibitor compounds and uses thereof 河南迈英诺医药科技有限公司 2024-05-17 CN disclosed
EP-4357347-A1 TRK KINASE INHIBITOR COMPOUND AND USE THEREOF Henan Medinno Pharmaceutical Technology Co., Ltd. (CN) 2024-04-24 EP disclosed
CN-115043844-A TRK kinase inhibitor compounds and uses thereof 河南迈英诺医药科技有限公司 2022-09-13 CN disclosed
US-9608291-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-28 US disclosed
US-9343777-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-05-17 US disclosed
US-9252457-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-02-02 US disclosed
US-20150188192-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2015-07-02 US disclosed
US-20120177988-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-07-12 US disclosed
US-20120070731-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-03-22 US disclosed
US-20090325065-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2009-12-31 US disclosed