SCHEMBL19490986

SCHEMBL19490986

CCCCOc1c(OC)cc([C@@H](O)C2CO2)cc1OC

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PDE4D Q08499 1/20 0.40
▸ SLC6A5 Q9Y345 8/20 0.39
▸ HTR2A P28223 2/20 0.39
▸ P2RX3 P56373 1/20 0.39
▸ SRC P12931 1/20 0.38

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
SCHEMBL16562794 1.00 PDE4D (0.40) PDE4DSLC6A5HTR2AP2RX3SRC
SCHEMBL16562878 1.00 PDE4D (0.40) PDE4DSLC6A5HTR2AP2RX3SRC
SCHEMBL13138924 0.92 PDE4D (0.34) PDE4DSLC6A5HTR2AP2RX3
SCHEMBL17375719 0.82 ACHE (0.51) —
SCHEMBL17371470 0.82 ACHE (0.51) —
SCHEMBL16553285 0.78 FAAH (0.44) SLC6A5
SCHEMBL16553284 0.78 FAAH (0.44) SLC6A5
SCHEMBL17135859 0.78 FAAH (0.44) SLC6A5
SCHEMBL17135857 0.78 FAAH (0.44) SLC6A5
SCHEMBL16553283 0.78 FAAH (0.44) SLC6A5

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
US-9795583-B2 Composition for preventing or treating heart disease AMOREPACIFIC CORPORATION (KR) 2017-10-24 — — US disclosed
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