SCHEMBL9952240

SCHEMBL9952240

CCCCC(C)(CC)C(=O)OCC1CO1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
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
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
ENPP2 Q13822 1/20 0.34
LPAR2 Q9HBW0 1/20 0.34
MGLL Q99685 1/20 0.32

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
SCHEMBL10773349 0.95 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4
SCHEMBL19651997 0.91 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4
SCHEMBL25797198 0.91 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4
SCHEMBL21769282 0.90 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4
SCHEMBL9925442 0.87 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4
SCHEMBL12026823 0.84 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4
SCHEMBL12900126 0.84 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4
SCHEMBL11160355 0.83 CA2 (0.41) ALDH1A1
SCHEMBL2850663 0.82 ALDH1A1 (0.40) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL29317073 0.82 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4

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 87 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2768903-B1 POLYETHER POLYOL RESINS COMPOSITIONS HEXION RES BELGIUM SA (BE) 2020-06-03 EP claimed
CN-106147462-B Glycidyl esters of alpha, alpha-branched acids compositions 瀚森公司 2020-01-03 CN claimed
US-20190119510-A1 GLYCIDYL ESTERS OF ALPHA, ALPHA BRANCHED ACIDS COMPOSITIONS HEXION INC. (US) 2019-04-25 US claimed
EP-2661430-B1 GLYCIDYL ESTERS OF ALPHA, ALPHA BRANCHED ACIDS COMPOSITIONS HEXION RES BELGIUM SA (BE) 2018-11-14 EP claimed
EP-2655351-B1 GLYCIDYL ESTERS OF ALPHA, ALPHA BRANCHED ACIDS COMPOSITIONS HEXION RES BELGIUM SA (BE) 2018-06-20 EP claimed
US-9803051-B2 Acrylic polyol resins compositions HEXION INC. (US) 2017-10-31 US claimed
US-9751982-B2 Polyether polyol resins compositions HEXION INC (US) 2017-09-05 US claimed
US-9663597-B2 Acrylic polyol resins compositions HEXICON INC. (US) 2017-05-30 US claimed
CN-106147462-A The glycidyl esters compositions of the branched acid of α, α 瀚森公司 2016-11-23 CN claimed
CN-103298798-B Glycidyl esters of alpha, alpha-branched acids compositions 瀚森公司 2016-08-10 CN claimed
WO-2013056814-A2 POLYETHER POLYOL RESINS COMPOSITIONS MOMENTIVE SPECIALTY CHEMICALS RESEARCH BEIGIUM S.A. (BE) 2013-04-25 WO claimed
WO-2013056812-A1 ACRYLIC POLYOL RESINS COMPOSITIONS MOMENTIVE SPECIALTY CHEMICALS RESEARCH BELGIUM SA (BE) 2013-04-25 WO claimed
WO-2013056816-A1 POLYESTER POLYOL RESINS COMPOSITIONS MOMENTIVE SPECIALTY CHEMICALS RESEARCH BELGIUM SA (BE) 2013-04-25 WO claimed
WO-2013056815-A1 ACRYLIC POLYOL RESINS COMPOSITIONS MOMENTIVE SPECIALTY CHEMICALS RESEARCH BELGIUM SA (BE) 2013-04-25 WO claimed
WO-2013056813-A1 POLYESTER POLYOL RESINS COMPOSITIONS MOMENTIVE SPECIALTY CHEMICALS (BE) 2013-04-25 WO claimed
WO-2013056817-A1 POLYETHER POLYOL RESIN COMPOSITIONS MOMENTIVE SPECIALTY CHEMICALS RESEARCH BELGIUM SA (BE) 2013-04-25 WO claimed
EP-2476672-A1 Glycidyl esters of alpha , alpha branched acids compositions Momentive Specialty Chemicals Research Belgium S.A. (BE) 2012-07-18 EP claimed
EP-2474537-A1 glycidyl esters of alpha, alpha branched acids compositions Momentive Specialty Chemicals Research Belgium S.A. (BE) 2012-07-11 EP claimed
WO-2012084265-A1 GLYCIDYL ESTERS OF ALPHA, ALPHA BRANCHED ACIDS COMPOSITIONS MOMENTIVE SPECIALTY CHEMICALS RESEARCH S.A. (BE) 2012-06-28 WO claimed
WO-2012084266-A1 GLYCIDYL ESTERS OF ALPHA, ALPHA BRANCHED ACIDS COMPOSITIONS MOMENTIVE SPECIALTY CHEMICALS RESEARCH S.A. (BE) 2012-06-28 WO claimed

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.