SCHEMBL5023256

SCHEMBL5023256

CCCCCCOC(OCC)C(O)CO

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.46
ALDH1A1 P00352 1/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
DNM1 Q05193 1/20 0.40
HTT P42858 3/20 0.39
CYP2D6 P10635 2/20 0.39
MAPT P10636 2/20 0.39
SPHK1 Q9NYA1 2/20 0.39
LMNA P02545 2/20 0.39
GMNN O75496 1/20 0.39
POLB P06746 1/20 0.39
THPO P40225 1/20 0.39
MTOR P42345 1/20 0.39
BLM P54132 1/20 0.39
KDM4E B2RXH2 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CETP P11597 1/20 0.39

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
SCHEMBL4649577 0.85 USP2 (0.46) USP2ALDH1A1CNR1CNR2DNM1
SCHEMBL14391447 0.84 USP2 (0.34) USP2LMNATHRB
SCHEMBL14419224 0.84 USP2 (0.34) USP2LMNATHRB
SCHEMBL5342645 0.82 USP2 (0.43) USP2ALDH1A1CNR1CNR2DNM1
SCHEMBL13573098 0.82 LMNA (0.38) LMNAKDM4ETHRBMGAM
SCHEMBL9443589 0.82 LMNA (0.38) LMNAKDM4ETHRBMGAM
SCHEMBL12846443 0.81 TSHR (0.45) USP2ALDH1A1CNR1CNR2HTT
SCHEMBL14628004 0.80 ALDH1A1 (0.37) ALDH1A1LMNATHRB
SCHEMBL20788856 0.79 USP2 (0.50) USP2ALDH1A1CNR1CNR2DNM1
SCHEMBL20788813 0.79 USP2 (0.50) USP2ALDH1A1CNR1CNR2DNM1

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-20140301998-A1 PREPARATION CONTAINING DIOL BEIERSDORF AG (DE) 2014-10-09 US disclosed
EP-1902043-A1 VANILLIN ACETALS AND SENSORY STIMULANT COMPOSITION CONTAINING THE SAME Takasago International Corporation (JP) 2008-03-26 EP disclosed
WO-2007004740-A1 VANILLIN ACETALS AND SENSORY STIMULANT COMPOSITION CONTAINING THE SAME TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-01-11 WO 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-20140301998-A1 PREPARATION CONTAINING DIOL DHCR7, ADH1C, DHCR24 USP2 848/4885ALDH1A1 93/4885CNR1 1510/4885

“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.