SCHEMBL534176

SCHEMBL534176

C=C(C)C(=O)Oc1ccc(CC(C)c2ccc(OC(=O)C(=C)C)c(OCC)c2OCC)c(OCC)c1OCC

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ACACB O00763 3/20 0.30
ELANE P08246 1/20 0.30
CREBBP Q92793 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30
TSHR P16473 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
SCHEMBL29817538 1.00 ALDH1A1 (0.31) ALDH1A1KDM4EHPGDHSD17B10L3MBTL1
SCHEMBL7084293 0.89 ALDH1A1 (0.34) ALDH1A1KDM4EHPGDHSD17B10L3MBTL1
SCHEMBL29601329 0.89 ALDH1A1 (0.34) ALDH1A1KDM4EHPGDHSD17B10L3MBTL1
SCHEMBL5698005 0.89 ALDH1A1 (0.34) ALDH1A1KDM4EHPGDHSD17B10L3MBTL1
SCHEMBL30384808 0.84 MEN1 (0.34) ALDH1A1TSHR
SCHEMBL14874589 0.84 MEN1 (0.34) ALDH1A1TSHR
SCHEMBL6424052 0.84 THRB (0.38) ALDH1A1ACACB
SCHEMBL330418 0.83 HSD17B10 (0.35) ALDH1A1KDM4EHPGDHSD17B10L3MBTL1
SCHEMBL29489300 0.83 HSD17B10 (0.35) ALDH1A1KDM4EHPGDHSD17B10L3MBTL1
SCHEMBL2457034 0.80 L3MBTL1 (0.36) ALDH1A1KDM4EHPGDHSD17B10L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230132972-A1 PROCESS FOR PREPARING A DENTAL RESIN-MODIFIED GLASS IONOMER COMPOSITION DENTSPLY SIRONA INC. (US) 2023-05-04 US disclosed
EP-3559054-B1 PROCESS FOR PREPARING A DENTAL RESIN-MODIFIED GLASS IONOMER COMPOSITION DENTSPLY DETREY GMBH (DE) 2020-10-14 EP disclosed
EP-3559054-A1 PROCESS FOR PREPARING A DENTAL RESIN-MODIFIED GLASS IONOMER COMPOSITION Dentsply DeTrey GmbH (DE) 2019-10-30 EP disclosed
WO-2018114415-A1 PROCESS FOR PREPARING A DENTAL RESIN-MODIFIED GLASS IONOMER COMPOSITION DENTSPLY DETREY GMBH (DE) 2018-06-28 WO disclosed
EP-3339335-A1 PROCESS FOR PREPARING A DENTAL RESIN-MODIFIED GLASS IONOMER COMPOSITION Dentsply DeTrey GmbH (DE) 2018-06-27 EP disclosed
EP-2415794-A1 CURABLE COMPOSITION AND CURED PRODUCT THEREOF Showa Denko K.K. (JP) 2012-02-08 EP 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-20230132972-A1 PROCESS FOR PREPARING A DENTAL RESIN-MODIFIED GLASS IONOMER COMPOSITION PICALM, COG1, GYPA ALDH1A1 1756/4885KDM4E 1531/4885HPGD 2035/4885

“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.