SCHEMBL3027650

SCHEMBL3027650

CCCOCC(C)OCC(C)OC(=O)C(O)CC(=O)O

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.53
HSD17B10 Q99714 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL3023590 0.88 TDP1 (0.37) TDP1SMN1; SMN2
SCHEMBL3010216 0.85 SMN1; SMN2 (0.33) TDP1SMN1; SMN2
SCHEMBL3017335 0.83 SMN1; SMN2 (0.36) SMN1; SMN2
SCHEMBL3029625 0.81 TDP1 (0.54) TDP1HSD17B10
SCHEMBL2959965 0.81 TDP1 (0.41) TDP1HSD17B10SMN1; SMN2
Malic Acid SCHEMBL2952799 0.79 TDP1 (0.59) TDP1HSD17B10SMN1; SMN2
Malic Acid SCHEMBL2963342 0.77 TDP1 (0.60) TDP1HSD17B10SMN1; SMN2
SCHEMBL2946939 0.77 TDP1 (0.59) TDP1HSD17B10
SCHEMBL2944561 0.77 TDP1 (0.59) TDP1HSD17B10
SCHEMBL487418 0.77 TDP1 (0.59) TDP1HSD17B10SMN1; SMN2

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
EP-2392314-B1 OILY HAIR COSMETIC KOKYU ALCOHOL KOGYO CO LTD (JP) 2019-08-14 EP disclosed
US-8562957-B2 Oily hair cosmetics KOKYU ALCOHOL KOGYO CO., LTD. (JP) 2013-10-22 US disclosed
US-20100203003-A1 Oily Hair Cosmetics KOKYU ALCOHOL KOGYO CO., LTD. (JP) 2010-08-12 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-20100203003-A1 Oily Hair Cosmetics H1-0, H1-2, H1-3 TDP1 2137/4885HSD17B10 606/4885SMN1; SMN2 3778/4885

“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.