SCHEMBL12656304

SCHEMBL12656304

CCC(C)(COC(C)=O)CC(C)(CC)C(C)=O

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
LMNA P02545 2/20 0.37
HSD17B10 Q99714 2/20 0.37
TSHR P16473 1/20 0.31
GAA P10253 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
SCHEMBL15024590 0.82 ALDH1A1 (0.48) ALDH1A1LMNAHSD17B10TSHRGAA
SCHEMBL10171465 0.82 ALDH1A1 (0.48) ALDH1A1LMNAHSD17B10TSHRGAA
SCHEMBL12656302 0.79
SCHEMBL14076148 0.76 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10TSHRGAA
SCHEMBL13615363 0.75 ALDH1A1 (0.43) ALDH1A1LMNAHSD17B10TSHRGAA
SCHEMBL3199088 0.75 ALDH1A1 (0.48) ALDH1A1LMNAHSD17B10TSHRGAA
SCHEMBL16175936 0.75 TDP1 (0.35) ALDH1A1TSHRGAA
SCHEMBL15542597 0.75 LMNA (0.57) ALDH1A1LMNAHSD17B10TSHRGAA
SCHEMBL18034657 0.75 GAA (0.43) ALDH1A1LMNAHSD17B10GAA
SCHEMBL14886607 0.75 ALDH1A1 (0.31) ALDH1A1

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
US-7947846-B2 15-OXA-steroid compounds HARBOR BIOSCIENCES, INC. (US) 2011-05-24 US disclosed
US-20100222425-A1 COMPOSITIONS AND TREATMENT METHODS-2 BIOVIE INC. 2010-09-02 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-20100222425-A1 COMPOSITIONS AND TREATMENT METHODS-2 MPL, THPO, HSD3B2 ALDH1A1 2053/4885LMNA 3738/4885HSD17B10 285/4885

“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.