SCHEMBL12394595

SCHEMBL12394595

COC(CCCC1C(O)C[C@@]2(C)C3C[C@H](O)C4C(C)(C)C(O)CCC45CC35CCC12C)C(C)(C)O

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 1/20 0.35
▸ HSD11B2 P80365 1/20 0.35
▸ PPARG P37231 1/20 0.35
▸ PSEN1 P49768 1/20 0.33
▸ PSEN2 P49810 1/20 0.33
▸ APH1B Q8WW43 1/20 0.33
▸ NCSTN Q92542 1/20 0.33
▸ APH1A Q96BI3 1/20 0.33
▸ PSENEN Q9NZ42 1/20 0.33
▸ TYR P14679 3/20 0.33
▸ ACLY P53396 1/20 0.30
▸ ACACA Q13085 1/20 0.30

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
SCHEMBL24068231 0.88 HSD11B1 (0.44) HSD11B1HSD11B2PPARGPSEN1PSEN2
SCHEMBL19647510 0.85 TYR (0.40) TYR
SCHEMBL16063114 0.78 TYR (0.55) HSD11B1HSD11B2PSEN1PSEN2APH1B
SCHEMBL12332641 0.78 TYR (0.55) HSD11B1HSD11B2PSEN1PSEN2APH1B
SCHEMBL4232635 0.74 HSD11B1 (0.52) HSD11B1HSD11B2PPARGPSEN1PSEN2
SCHEMBL29925026 0.74 HSD11B1 (0.52) HSD11B1HSD11B2PPARGPSEN1PSEN2
SCHEMBL4232633 0.74 HSD11B1 (0.52) HSD11B1HSD11B2PPARGPSEN1PSEN2
SCHEMBL24068239 0.73 HSD11B1 (0.43) HSD11B1HSD11B2PPARGPSEN1PSEN2
SCHEMBL19647469 0.70 TYR (0.41) PPARGPSEN1PSEN2APH1BNCSTN
SCHEMBL24068242 0.69 HSD11B1 (0.45) HSD11B1HSD11B2PPARGPSEN1PSEN2

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-8003628-B2 Methods of inhibiting osteoclast activity THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2011-08-23 — — US disclosed
US-20090306030-A1 Methods Of Inhibiting Osteoclast Activity THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2009-12-10 — — US disclosed
US-7566741-B2 Methods of inhibiting osteoclast activity THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2009-07-28 — — 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-20090306030-A1 Methods Of Inhibiting Osteoclast Activity NFATC1, CD40LG, CD14 HSD11B1 3360/4885HSD11B2 3407/4885PPARG 1254/4885

“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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