SCHEMBL2959293

SCHEMBL2959293

CC(C)OCCOC(=O)CCC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.42
ADRA1A P35348 1/20 0.42
EGLN1 Q9GZT9 2/20 0.41
MAPT P10636 1/20 0.41
BLM P54132 1/20 0.41
KDM6B O15054 1/20 0.41
KDM5C P41229 1/20 0.41
PHF8 Q9UPP1 1/20 0.41
KDM2A Q9Y2K7 1/20 0.41
DGKA P23743 1/20 0.39
LMNA P02545 3/20 0.38
TDP1 Q9NUW8 1/20 0.37
ALKBH5 Q6P6C2 1/20 0.36
SUCNR1 Q9BXA5 1/20 0.36
ALDH1A1 P00352 2/20 0.36
NPC1 O15118 1/20 0.36
SLC15A2 Q16348 1/20 0.34
GABRP O00591 2/20 0.34
GABRD O14764 2/20 0.34
GABRA1 P14867 2/20 0.34

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
SCHEMBL2963345 0.94 ADRA2A (0.38) ADRA2AADRA1AEGLN1MAPTBLM
SCHEMBL2955661 0.89 DGKA (0.50) MAPTDGKALMNATDP1ALDH1A1
SCHEMBL3028188 0.84 DGKA (0.46) MAPTDGKALMNAALDH1A1NPC1
SCHEMBL2953064 0.84 ALDH1A1 (0.38) ADRA2AADRA1AEGLN1MAPTBLM
SCHEMBL409092 0.82 LMNA (0.53) ADRA2AADRA1AEGLN1MAPTBLM
SCHEMBL24490854 0.82 ADRA2A (0.43) ADRA2AADRA1AEGLN1MAPTBLM
SCHEMBL27646117 0.82 DGKA (0.50) ADRA2AADRA1AMAPTBLMDGKA
SCHEMBL11411505 0.80 ADRA2A (0.36) ADRA2AADRA1AEGLN1MAPTBLM
SCHEMBL30207417 0.80 LMNA (0.50) ADRA2AADRA1AEGLN1MAPTBLM
SCHEMBL16858300 0.80 CA1 (0.40) ADRA2AADRA1AMAPTBLMDGKA

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-7766978-B2 Acidic hair dyeing method KOKYU ALCOHOL KOGYO CO., LTD. (JP) 2010-08-03 US disclosed
US-20090100609-A1 ACIDIC HAIR DYE COMPOSITION KOKYU ALCOHOL KOGYO CO., LTD. (JP) 2009-04-23 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-20090100609-A1 ACIDIC HAIR DYE COMPOSITION H1-0, MRM1, H1-4 ADRA2A 3928/4885ADRA1A 2170/4885EGLN1 982/4885

“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.