SCHEMBL4140289

SCHEMBL4140289

CC(COCCOC(=O)O)OCCOC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL10421802 0.85 TDP1 (0.41) TDP1
SCHEMBL1341695 0.84 ALDH1A1 (0.52) TDP1ALDH1A1TSHRHSD17B10
SCHEMBL28882457 0.83 TSHR (0.39) TDP1TSHR
SCHEMBL25701625 0.82 TDP1 (0.44) TDP1ALDH1A1TSHRHSD17B10
SCHEMBL11411505 0.80 ADRA2A (0.36) TDP1ALDH1A1
SCHEMBL12119519 0.80 TDP1 (0.41) TDP1TSHRHSD17B10
SCHEMBL15315312 0.79 TDP1 (0.38) TDP1ALDH1A1TSHR
SCHEMBL12119405 0.79 ADRA2A (0.35) TDP1
SCHEMBL8835852 0.79 HCAR2 (0.51) TDP1ALDH1A1TSHRHSD17B10
Acetic Acid SCHEMBL7263283 0.78 ALDH1A1 (0.45) TDP1ALDH1A1TSHRHSD17B10

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-8343467-B2 Glycopyrrolate in cosmetic preparations BEIERSDORF AG (DE) 2013-01-01 US disclosed
US-20090208437-A1 GLYCOPYRROLATE IN COSMETIC PREPARATIONS BEIERSDORF AG (DE) 2009-08-20 US disclosed
US-5254746-A Using hydrogen peroxide in presence of a zeolite RHONE-POULENC CHIMIE (FR) 1993-10-19 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-20090208437-A1 GLYCOPYRROLATE IN COSMETIC PREPARATIONS GYPA, TPO, DDT TDP1 1452/4885ALDH1A1 2004/4885TSHR 31/4885

“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.