SCHEMBL16562878

SCHEMBL16562878

CCCCOc1c(OC)cc([C@H](O)[C@@H]2CO2)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
SCHEMBL19490986 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 3 patents. 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
US-20150283110-A1 COMPOSITION FOR PREVENTING OR TREATING HEART DISEASE AMOREPACIFIC CORPORATION (KR) 2015-10-08 — — US disclosed
US-20150073158-A1 METHOD FOR PREPARING FUROFURAN LIGNAN COMPOUND AMOREPACIFIC CORPORATION (KR) 2015-03-12 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150073158-A1 METHOD FOR PREPARING FUROFURAN LIGNAN COMPOUND CYP4F2, UGT1A7, UGT1A3 PDE4D 3781/4885SLC6A5 3796/4885HTR2A 2918/4885
US-20150283110-A1 COMPOSITION FOR PREVENTING OR TREATING HEART DISEASE SIRT1, SIRT3, SIRT2 PDE4D 2881/4885SLC6A5 4736/4885HTR2A 3837/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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