SCHEMBL3885276

SCHEMBL3885276

Cc1ccc(CCCC(C)P(=O)(O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 4/20 0.51
ENPP2 Q13822 1/20 0.44
S1PR1 P21453 4/20 0.42
S1PR3 Q99500 4/20 0.42
S1PR2 O95136 3/20 0.42
S1PR4 O95977 3/20 0.42
IGF1R P08069 1/20 0.42
ALOX15 P16050 1/20 0.42
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
MMP8 P22894 1/20 0.40

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
SCHEMBL10106296 0.83 FDFT1 (0.56) FDFT1ENPP2S1PR1S1PR3S1PR2
SCHEMBL1237801 0.79 FDFT1 (0.61) FDFT1MMP8
SCHEMBL3889192 0.78 MMP8 (0.44) CA12CA1MMP8
SCHEMBL413324 0.77 FDFT1 (0.60) FDFT1MMP8
SCHEMBL3883992 0.76 ACP3 (0.65) FDFT1
SCHEMBL1827950 0.76 IGF1R (0.48) FDFT1IGF1RALOX15
SCHEMBL777295 0.76 KMT2A (0.49) S1PR1S1PR3S1PR2
SCHEMBL14676054 0.75 CYP1A2 (0.48) FDFT1IGF1RALOX15
SCHEMBL9954935 0.74 KCNH2 (0.51) ENPP2S1PR1S1PR3S1PR2S1PR4
SCHEMBL13870218 0.74 LTB4R (0.48) FDFT1IGF1RALOX15

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
US-9608291-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-28 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-20090325065-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2009-12-31 US disclosed