SCHEMBL28056148

SCHEMBL28056148

C=CO[PH](=O)OCCC1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.36
CYP1A2 P05177 1/20 0.31
EPHX1 P07099 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL27770091 0.80 LMNA (0.30)
SCHEMBL19974093 0.73 CYP1A2 (0.42) NFE2L2CYP1A2EPHX1HPGD
SCHEMBL28056099 0.72 NFE2L2 (0.41) NFE2L2CYP1A2EPHX1HPGD
SCHEMBL683416 0.71 NFE2L2 (0.39) NFE2L2CYP1A2EPHX1HPGD
SCHEMBL19974214 0.71 CYP1A2 (0.39) NFE2L2CYP1A2EPHX1
SCHEMBL19974044 0.68 CYP1A2 (0.50) NFE2L2CYP1A2EPHX1
SCHEMBL28420580 0.64 ITGB3 (0.33)
SCHEMBL779644 0.64 METAP1 (0.36) NFE2L2CYP1A2EPHX1HPGD
SCHEMBL2316985 0.64 TSHR (0.48) EPHX1HPGD
SCHEMBL26935991 0.64 TSHR (0.48) EPHX1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103259044-B Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery MITSUBISHI CHEMICAL CORP. (JP) 2016-02-10 CN disclosed