SCHEMBL9960265

SCHEMBL9960265

CCCCC(C)CC(=O)OCC1CO1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.39
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
TLR4 O00206 1/20 0.37
MGLL Q99685 2/20 0.37

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
SCHEMBL16640714 0.84 LPAR1 (0.48) MGLL
SCHEMBL1715067 0.84 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4
Water SCHEMBL28201965 0.82 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4
SCHEMBL28197584 0.82 CA2 (0.45) ALDH1A1SMN1; SMN2TLR4MGLL
SCHEMBL1441621 0.81 LPAR1 (0.51) MGLL
Water SCHEMBL28201966 0.81 CA2 (0.44) ALDH1A1SMN1; SMN2TLR4MGLL
SCHEMBL28096991 0.80 ALDH1A1 (0.45) ALDH1A1TP53CYP3A4MGLL
SCHEMBL14256247 0.79 ALDH1A1 (0.50) ALDH1A1TP53CYP3A4MGLL
SCHEMBL29049547 0.78 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2TDP1TLR4
SCHEMBL11969676 0.77 LMNA (0.53) MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190119510-A1 GLYCIDYL ESTERS OF ALPHA, ALPHA BRANCHED ACIDS COMPOSITIONS HEXION INC. (US) 2019-04-25 US disclosed
EP-2661430-B1 GLYCIDYL ESTERS OF ALPHA, ALPHA BRANCHED ACIDS COMPOSITIONS HEXION RES BELGIUM SA (BE) 2018-11-14 EP disclosed
US-20140005300-A1 GLYCIDYL ESTERS OF ALPHA, ALPHA BRANCHED ACIDS COMPOSITIONS MOMENTIVE SPECIALITY CHEMICALS INC. (US) 2014-01-02 US disclosed
EP-2661430-A1 GLYCIDYL ESTERS OF ALPHA, ALPHA BRANCHED ACIDS COMPOSITIONS Momentive Specialty Chemicals Research Belgium S.A. (BE) 2013-11-13 EP disclosed
WO-2012084265-A1 GLYCIDYL ESTERS OF ALPHA, ALPHA BRANCHED ACIDS COMPOSITIONS MOMENTIVE SPECIALTY CHEMICALS RESEARCH S.A. (BE) 2012-06-28 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-20190119510-A1 GLYCIDYL ESTERS OF ALPHA, ALPHA BRANCHED ACIDS COMPOSITIONS GNE, B3GAT3, GALE ALDH1A1 991/4885SMN1; SMN2 483/4885TDP1 3358/4885

“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.