SCHEMBL1665130

SCHEMBL1665130

O=C(O)C1C2OC(C3OC32)C1C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.65
TFPI2 P48307 3/20 0.46
KDM4E B2RXH2 2/20 0.46
GMNN O75496 1/20 0.46
LMNA P02545 1/20 0.46
PMP22 Q01453 1/20 0.46
TP53 P04637 1/20 0.46
NFKB1 P19838 1/20 0.46
THPO P40225 1/20 0.46
PPP5C P53041 2/20 0.44
SUCNR1 Q9BXA5 1/20 0.42
POLB P06746 3/20 0.35
TDP1 Q9NUW8 3/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
PPM1B O75688 1/20 0.33
PTPN1 P18031 1/20 0.33
APEX1 P27695 1/20 0.33
PPP1CC P36873 1/20 0.33
GRM2 Q14416 2/20 0.32
GRM8 O00222 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
SCHEMBL7827217 1.00 TSHR (0.65) TSHRTFPI2KDM4EGMNNLMNA
SCHEMBL15796345 0.90 TSHR (0.68) TSHRTFPI2KDM4EGMNNLMNA
Hydrochloric Acid SCHEMBL9445206 0.87 TSHR (0.65) TSHRTFPI2KDM4EGMNNLMNA
SCHEMBL14972599 0.81 TSHR (0.59) TSHRTFPI2KDM4EGMNNLMNA
SCHEMBL6723339 0.81 TSHR (0.59) TSHRTFPI2KDM4EGMNNLMNA
SCHEMBL6723333 0.81 TSHR (0.59) TSHRTFPI2KDM4EGMNNLMNA
SCHEMBL1663194 0.71 TFPI2 (0.50) TSHRTFPI2KDM4EGMNNLMNA
SCHEMBL1663988 0.71 TSHR (0.48) TSHRTFPI2KDM4EGMNNLMNA
SCHEMBL676573 0.69 POLB (0.47) TSHRTFPI2KDM4EGMNNLMNA
SCHEMBL9782987 0.69 POLB (0.47) TSHRTFPI2KDM4EGMNNLMNA

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
EP-2307476-A1 ASYMMETRIC CYCLIC DIESTER COMPOUNDS FERRO CORPORATION (US) 2011-04-13 EP disclosed
US-20100113664-A1 Asymmetric Cyclic Diester Compounds FERRO CORPORATION (US) 2010-05-06 US disclosed
WO-2009152068-A1 ASYMMETRIC CYCLIC DIESTER COMPOUNDS FERRO CORPORATION (US) 2009-12-17 WO disclosed
US-20090312470-A1 Asymmetric Cyclic Diester Compounds FERRO CORPORATION (US) 2009-12-17 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-20090312470-A1 Asymmetric Cyclic Diester Compounds DDT, PCNA, AADAC TSHR 4543/4885TFPI2 4764/4885KDM4E 1680/4885

“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.