SCHEMBL2321772

SCHEMBL2321772

CC1(C)CC(O)CC(C)(CNc2noc3ccccc23)C1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.50
KCNA5 P22460 1/20 0.43
ACHE P22303 2/20 0.39
EPHX2 P34913 7/20 0.39
CHRNA7 P36544 2/20 0.36
HTR3A P46098 2/20 0.36
TP53 P04637 4/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
MAPT P10636 2/20 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
SCHEMBL2360179 0.77 HSD11B1 (0.45) HSD11B1ACHE
SCHEMBL12350968 0.77 HSD11B1 (0.43) HSD11B1HTR3AMAPT
SCHEMBL2318505 0.74 HSD11B1 (0.48) HSD11B1TP53SMN1; SMN2MAPT
SCHEMBL12350687 0.74 HSD11B1 (0.46) HSD11B1EPHX2TP53SMN1; SMN2MAPT
SCHEMBL2360451 0.72 KDM4E (0.43) HSD11B1EPHX2TP53SMN1; SMN2
SCHEMBL2319306 0.70 HSD11B1 (0.43) HSD11B1SMN1; SMN2MAPT
SCHEMBL2322874 0.69 HSD11B1 (0.41) HSD11B1TP53SMN1; SMN2MAPT
SCHEMBL12350878 0.69 SSTR4 (0.37) HSD11B1
SCHEMBL2324011 0.68 HSD11B1 (0.43) HSD11B1
SCHEMBL2322132 0.68 HSD11B1 (0.41) HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011095576-A1 COMPOUNDS FOR THE TREATMENT AND PREVENTION OF INFLUENZA F. HOFFMANN-LA ROCHE AG (CH) 2011-08-11 WO claimed
WO-2011094953-A1 COMPOUNDS FOR THE TREATMENT AND PREVENTION OF INFLUENZA F. HOFFMANN-LA ROCHE AG (CH) 2011-08-11 WO claimed
WO-2011094953-A1 COMPOUNDS FOR THE TREATMENT AND PREVENTION OF INFLUENZA F. HOFFMANN-LA ROCHE AG (CH) 2011-08-11 WO disclosed
WO-2011095576-A1 COMPOUNDS FOR THE TREATMENT AND PREVENTION OF INFLUENZA F. HOFFMANN-LA ROCHE AG (CH) 2011-08-11 WO disclosed
US-20110195979-A1 COMPOUNDS FOR THE TREATMENT AND PREVENTION OF INFLUENZA F. HOFFMANN-LA ROCHE AG (CH) 2011-08-11 US disclosed
US-20110195979-A1 COMPOUNDS FOR THE TREATMENT AND PREVENTION OF INFLUENZA F. HOFFMANN-LA ROCHE AG (CH) 2011-08-11 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 (1 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-20110195979-A1 COMPOUNDS FOR THE TREATMENT AND PREVENTION OF INFLUENZA NAT1, NHERF1, ADORA1 HSD11B1 433/4885KCNA5 2025/4885ACHE 856/4885

“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.