SCHEMBL16769340

SCHEMBL16769340

O=C1OCC(COCC(O)CO)O1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
CYP2D6 P10635 4/20 0.39
MAPT P10636 2/20 0.38
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 0.38
CYP2C19 P33261 3/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
LMNA P02545 2/20 0.36
CYP2C9 P11712 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
ALOX15 P16050 1/20 0.35
USP2 O75604 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
SCHEMBL16769341 0.97 ALDH1A1 (0.39) ALDH1A1CYP2D6MAPTPRMT5WDR77
SCHEMBL15427608 0.92 ALDH1A1 (0.43) ALDH1A1CYP2D6MAPTPRMT5WDR77
SCHEMBL21432198 0.91 ALDH1A1 (0.36) ALDH1A1CYP2D6MAPTPRMT5WDR77
SCHEMBL22490185 0.87 ALDH1A1 (0.39) ALDH1A1CYP2D6MAPTPRMT5WDR77
SCHEMBL16450875 0.86 ALDH1A1 (0.44) ALDH1A1CYP2D6MAPTPRMT5WDR77
SCHEMBL16450907 0.84 ALDH1A1 (0.42) ALDH1A1CYP2D6MAPTPRMT5WDR77
SCHEMBL16450876 0.83 ALDH1A1 (0.34) ALDH1A1CYP2D6MAPTPRMT5WDR77
SCHEMBL15445678 0.82 ALDH1A1 (0.38) ALDH1A1CYP2D6MAPTPRMT5WDR77
SCHEMBL17028973 0.82 KDM4E (0.33) LMNAMEN1KMT2A
SCHEMBL21432313 0.81 KDM4E (0.33) LMNAMEN1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9242956-B2 Method for producing polyglycerol (poly)carbonate RHODIA OPERATIONS (FR) 2016-01-26 US disclosed
US-9242956-B2 Method for producing polyglycerol (poly)carbonate RHODIA OPERATIONS (FR) 2016-01-26 US disclosed
US-20150152079-A1 Method for producing polyglycerol (poly)carbonate CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2015-06-04 US disclosed
US-20150152079-A1 Method for producing polyglycerol (poly)carbonate CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2015-06-04 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-20150152079-A1 Method for producing polyglycerol (poly)carbonate PHOSPHO1, ALG1, AGL ALDH1A1 4234/4885CYP2D6 4283/4885MAPT 4135/4885

“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.