SCHEMBL779405

SCHEMBL779405

O=P(O)(O)C(CCC1CCCCC1)C(F)(F)F

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.59
HPGD P15428 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MMP9 P14780 1/20 0.36
MMP8 P22894 1/20 0.36
CA9 Q16790 1/20 0.36
FDPS P14324 1/20 0.35
ANPEP P15144 2/20 0.34
ERAP2 Q6P179 2/20 0.34
SIGMAR1 Q99720 1/20 0.33
ACP3 P15309 1/20 0.33
KDM5A P29375 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33

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
SCHEMBL777378 0.84 METAP1 (0.47) METAP1CA12CA1CA2MMP1
SCHEMBL7805193 0.70 METAP1 (0.57) METAP1HPGDCA12CA1CA2
SCHEMBL17333514 0.69 SIGMAR1 (0.52) METAP1CA12CA1CA2MMP1
SCHEMBL9116073 0.69 METAP1 (0.56) METAP1HPGDCA12CA1CA2
SCHEMBL777236 0.69 GRIN2D (0.35) METAP1FDPS
SCHEMBL779004 0.69 FDPS (0.50) METAP1FDPS
SCHEMBL17333510 0.68 SIGMAR1 (0.55) METAP1SIGMAR1KDM5AKDM4CPHF8
SCHEMBL8842723 0.68 METAP1 (0.54) METAP1HPGDCA12CA1CA2
SCHEMBL10773314 0.68 METAP1 (0.54) METAP1CA12CA1CA2MMP1
SCHEMBL10685188 0.67 METAP1 (0.49) METAP1HPGDCA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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