SCHEMBL9979492

SCHEMBL9979492

CC12CCC3C(C)(O)C(=O)CC(CC4OC4(C)CCC1O2)C3(C)C

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.38
PTAFR P25105 3/20 0.36
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP2C9 P11712 2/20 0.30
CYP2C19 P33261 2/20 0.30
FTH1 P02794 1/20 0.30
TSHR P16473 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
SCHEMBL9979494 0.76 HSD11B1 (0.35) CYP3A4PTAFRALDH1A1
SCHEMBL4442384 0.74 ALDH1A1 (0.35) ALDH1A1MEN1LMNAMAPTKMT2A
SCHEMBL8478854 0.74 ALDH1A1 (0.35) ALDH1A1MEN1LMNAMAPTKMT2A
SCHEMBL1171547 0.74 ALDH1A1 (0.35) ALDH1A1MEN1LMNAMAPTKMT2A
SCHEMBL8478851 0.74 ALDH1A1 (0.35) ALDH1A1MEN1LMNAMAPTKMT2A
SCHEMBL23295977 0.74 ALDH1A1 (0.35) ALDH1A1MEN1LMNAMAPTKMT2A
SCHEMBL1649604 0.74 ALDH1A1 (0.35) ALDH1A1MEN1LMNAMAPTKMT2A
SCHEMBL20721720 0.74 ALDH1A1 (0.35) ALDH1A1MEN1LMNAMAPTKMT2A
SCHEMBL22769642 0.74 ALDH1A1 (0.35) ALDH1A1MEN1LMNAMAPTKMT2A
SCHEMBL5935443 0.74 ALDH1A1 (0.35) ALDH1A1MEN1LMNAMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124654-B2 Derivatives of hypoestoxide and related compounds IMMUNE MODULATION, INC. (US) 2012-02-28 US disclosed
US-8124654-B2 Derivatives of hypoestoxide and related compounds IMMUNE MODULATION, INC. (US) 2012-02-28 US disclosed
US-20100120853-A1 Derivatives of Hypoestoxide and Related Compounds IMMUNE MODULATION, INC. (US) 2010-05-13 US disclosed
US-20100120853-A1 Derivatives of Hypoestoxide and Related Compounds IMMUNE MODULATION, INC. (US) 2010-05-13 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-20100120853-A1 Derivatives of Hypoestoxide and Related Compounds CYP8B1, HAAO, CYP27A1 CYP3A4 296/4885PTAFR 983/4885ALDH1A1 1438/4885

“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.