SCHEMBL17827615

SCHEMBL17827615

CCOCCOCCOC(=O)CCP(C)(C)=O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
TSHR P16473 1/20 0.47
THRB P10828 1/20 0.42
DGKA P23743 1/20 0.40
EPHX2 P34913 2/20 0.39
HSD17B10 Q99714 1/20 0.39
ADRA2A P08913 1/20 0.34
ADRA1A P35348 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MAPT P10636 1/20 0.33
BLM P54132 1/20 0.33
POLB P06746 1/20 0.33
CYP1A2 P05177 1/20 0.32
ALOX15 P16050 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
SCHEMBL3879046 0.82 ALDH1A1 (0.60) ALDH1A1TSHRTHRBDGKAEPHX2
SCHEMBL2303872 0.82 ALDH1A1 (0.60) ALDH1A1TSHRTHRBDGKAEPHX2
SCHEMBL28390346 0.81 DGKA (0.45) ALDH1A1DGKAADRA2AADRA1ASMN1; SMN2
SCHEMBL1108185 0.81 CYP1A2 (0.48) ALDH1A1TSHRHSD17B10SMN1; SMN2POLB
SCHEMBL1301905 0.80 ALDH1A1 (0.62) ALDH1A1TSHRTHRBDGKAEPHX2
SCHEMBL17826741 0.79 ALDH1A1 (0.44) ALDH1A1TSHRTHRBDGKAEPHX2
SCHEMBL17998753 0.79 DGKA (0.63) ALDH1A1TSHRTHRBDGKAEPHX2
SCHEMBL4250044 0.79 DGKA (0.63) ALDH1A1TSHRTHRBDGKAEPHX2
SCHEMBL181434 0.79 ALDH1A1 (0.56) ALDH1A1TSHRTHRBDGKAEPHX2
SCHEMBL28392407 0.78 DGKA (0.52) ALDH1A1TSHRDGKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9771319-B2 Cross-linker for the preparation of a new family of single ion conduction polymers for electrochemical devices and such polymers BELENOS CLEAN POWER HOLDING AG (CH) 2017-09-26 US disclosed
US-20160168086-A1 NOVEL CROSS-LINKER FOR THE PREPARATION OF A NEW FAMILY OF SINGLE ION CONDUCTION POLYMERS FOR ELECTROCHEMICAL DEVICES AND SUCH POLYMERS BELENOS CLEAN POWER HOLDING AG (CH) 2016-06-16 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-20160168086-A1 NOVEL CROSS-LINKER FOR THE PREPARATION OF A NEW FAMILY OF SINGLE ION CONDUCTION POLYMERS FOR ELECTROCHEMICAL DEVICES AND SUCH POLYMERS PPOX, PFAS, LPO ALDH1A1 2449/4885TSHR 4427/4885THRB 4134/4885

“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.