SCHEMBL27745115

SCHEMBL27745115

O=CC1C(O)OCCN1Cc1ccc(F)c(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 12/20 0.36
CHRM4 P08173 1/20 0.31

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
SCHEMBL27887744 0.84 CYP2A13 (0.43)
SCHEMBL27871497 0.76 CYP2A13 (0.43)
SCHEMBL27993463 0.76 CYP2A13 (0.43)
SCHEMBL28120392 0.75 MEN1 (0.41)
SCHEMBL27818451 0.75 MEN1 (0.41)
SCHEMBL27871595 0.74 ALDH1A1 (0.42) CHRM4
SCHEMBL27993464 0.74 SIRT2 (0.41)
SCHEMBL27887740 0.73 SMN1; SMN2 (0.47)
SCHEMBL4328665 0.73 P2RX7 (0.43) P2RX7CHRM4
SCHEMBL27887769 0.73 GBA1 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101312965-B Morpholine type cinnamamide compound EISAI R&D MAN CO LTD 2011-07-20 CN disclosed
CN-101312965-A Morpholine type cinnamamide compound EISAI R&D MAN CO LTD (JP) 2008-11-26 CN disclosed