SCHEMBL778955

SCHEMBL778955

O=S(=O)(O)c1ccc(Cc2ccc(F)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.47
ERBB2 P04626 6/20 0.47
LMNA P02545 1/20 0.46
CA1 P00915 6/20 0.45
CA2 P00918 6/20 0.45
MMP1 P03956 1/20 0.45
MMP2 P08253 1/20 0.45
MMP9 P14780 1/20 0.45
MMP8 P22894 1/20 0.45
MMP13 P45452 1/20 0.45
ALDH1A1 P00352 2/20 0.45
TSHR P16473 2/20 0.45
NT5E P21589 1/20 0.45
HTR2A P28223 1/20 0.45
KCNH2 Q12809 1/20 0.45
MEN1 O00255 1/20 0.44
PKM P14618 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
CA9 Q16790 4/20 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
SCHEMBL9619529 0.89 LMNA (0.56) LMNACA1CA2ALDH1A1TSHR
Hydrochloric Acid SCHEMBL7261261 0.87 LMNA (0.54) LMNACA1CA2ALDH1A1TSHR
SCHEMBL66196 0.87 LMNA (0.59) LMNACA1CA2MMP1MMP2
SCHEMBL778649 0.86 LMNA (0.42) EGFRERBB2LMNACA1CA2
Hydrochloric Acid SCHEMBL3278762 0.84 LMNA (0.56) LMNACA1CA2MMP1MMP2
SCHEMBL6918593 0.84 LMNA (0.56) LMNACA1CA2MMP1MMP2
SCHEMBL6912742 0.84 LMNA (0.56) LMNACA1CA2MMP1MMP2
SCHEMBL6914534 0.84 LMNA (0.56) LMNACA1CA2MMP1MMP2
SCHEMBL6114756 0.84 LMNA (0.56) LMNACA1CA2MMP1MMP2
SCHEMBL6914537 0.84 LMNA (0.56) LMNACA1CA2MMP1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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