SCHEMBL4357782

SCHEMBL4357782

CC(C=O)=CC1CC(C)CC(C)(C)C1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
LMNA P02545 2/20 0.32
HTT P42858 1/20 0.32
PPP1CA P62136 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL4343810 0.78 ALDH1A1 (0.34) ALDH1A1LMNAHTTPPP1CA
SCHEMBL809233 0.77 ALDH1A1 (0.39) ALDH1A1LMNAHTTPPP1CATDP1
SCHEMBL53053 0.77 ALDH1A1 (0.39) ALDH1A1LMNAHTTPPP1CATDP1
SCHEMBL4343812 0.77 TDP1 (0.39) ALDH1A1LMNAHTTPPP1CATDP1
SCHEMBL1412311 0.76 ALDH1A1 (0.38) ALDH1A1LMNAHTTPPP1CATDP1
SCHEMBL13751516 0.75 ALDH1A1 (0.33) ALDH1A1HTT
SCHEMBL4347325 0.75 ALDH1A1 (0.33) ALDH1A1HTT
SCHEMBL22501343 0.75 ALDH1A1 (0.37) ALDH1A1LMNAHTTPPP1CATDP1
SCHEMBL13751518 0.74 NR1I2 (0.34) ALDH1A1LMNA
SCHEMBL28208870 0.73 ALDH1A1 (0.37) ALDH1A1LMNAHTTPPP1CATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090209449-A1 NOVEL WOODY ODORANTS ORGANICA AROMATICS PVT LTD (IN) 2009-08-20 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-20090209449-A1 NOVEL WOODY ODORANTS ADH5, ADH1C, ADH1A ALDH1A1 9/4885LMNA 3944/4885HTT 4239/4885

“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.