SCHEMBL4240739

SCHEMBL4240739

CC(CCOCC(O)CO)CC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.44
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.34
PLA2G2C Q5R387 1/20 0.33
AGTR1 P30556 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 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
SCHEMBL101284 0.91 HSD17B10 (0.43) USP2HSD17B10TDP1
SCHEMBL8344012 0.81 LMNA (0.35) HSD17B10TDP1LMNA
SCHEMBL16809992 0.81 HSD17B10 (0.33) HSD17B10
SCHEMBL29690346 0.81 HSD17B10 (0.33) HSD17B10
SCHEMBL8343333 0.80 HSD17B10 (0.36) HSD17B10TDP1
SCHEMBL10421554 0.79 USP2 (0.33) USP2
SCHEMBL29690178 0.79 HSD17B10 (0.32) HSD17B10
SCHEMBL13157497 0.79 EGFR (0.30)
SCHEMBL3278006 0.78 EGFR (0.30)
SCHEMBL4393736 0.77 TSHR (0.42)

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-20090130029-A1 GLYCEROL ETHERS VEHICLE AND PHARMACEUTICAL COMPOSITIONS THEREOF FOAMIX LTD. (IL) 2009-05-21 US disclosed
US-7196052-B2 Fragrance composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-03-27 US disclosed
US-20030216283-A1 Fragrance composition TAKASAGO INTERNATIONAL CORPORATION 2003-11-20 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-20030216283-A1 Fragrance composition FAAH2, FAAH, DGAT1 USP2 3566/4885HSD17B10 41/4885TDP1 947/4885

“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.