SCHEMBL20407568

SCHEMBL20407568

C=C(CO)C(=O)OOc1cc(OOC)cc(-c2ccc(C3CCC(CCCCC(F)(F)F)CC3)cc2C)c1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 4/20 0.32
▸ MMP3 P08254 4/20 0.32
▸ MMP1 P03956 1/20 0.32
▸ MMP9 P14780 1/20 0.32
▸ MMP14 P50281 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
SCHEMBL19855430 0.86 MMP2 (0.37) MMP2MMP3MMP1MMP9MMP14
SCHEMBL20407728 0.85 MMP2 (0.41) MMP2MMP3MMP1MMP9MMP14
SCHEMBL19855953 0.80 MMP2 (0.38) MMP2MMP3MMP1MMP9MMP14
SCHEMBL20322921 0.77 FFAR4 (0.31) —
SCHEMBL19854410 0.77 MMP2 (0.38) MMP2MMP3MMP1MMP9MMP14
SCHEMBL20407414 0.76 MMP2 (0.42) MMP2MMP3MMP1MMP9MMP14
SCHEMBL20322936 0.75 ESR2 (0.33) —
SCHEMBL20407451 0.75 — —
SCHEMBL20322668 0.75 FFAR4 (0.34) —
SCHEMBL19855555 0.74 FFAR4 (0.34) —

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
EP-3351525-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2018-07-25 — — EP disclosed
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