SCHEMBL29024065

SCHEMBL29024065

O=C(OCCO)C1CC=CC1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35

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
SCHEMBL13406439 0.87 MIF (0.41) TSHR
SCHEMBL30368740 0.79 TSHR (0.39) TSHR
SCHEMBL30368963 0.79 TSHR (0.39) TSHR
SCHEMBL1297166 0.79 TSHR (0.39) TSHR
SCHEMBL21357046 0.79
SCHEMBL1297693 0.79 TSHR (0.39) TSHR
SCHEMBL2586974 0.76 MAPT (0.46)
SCHEMBL27699230 0.76 SMN1; SMN2 (0.42) TSHR
SCHEMBL11835168 0.75 MIF (0.44) TSHR
SCHEMBL3404743 0.74 ALDH1A1 (0.46)

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-109206417-B Opioid receptor agonists and uses thereof 四川海思科制药有限公司 2023-01-03 CN disclosed
CN-115124520-A Opioid receptor agonists and uses thereof 四川海思科制药有限公司 2022-09-30 CN disclosed