SCHEMBL13849599

SCHEMBL13849599

COC(=O)CCC(=O)OC(CF)C(F)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
LMNA P02545 3/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 3/20 0.37
HSD17B10 Q99714 3/20 0.37
MAPT P10636 2/20 0.37
HTT P42858 2/20 0.37
CA12 O43570 2/20 0.34
CA14 Q9ULX7 2/20 0.34
POLB P06746 1/20 0.34
GLA P06280 1/20 0.34
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
SLC1A1 P43005 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 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
SCHEMBL12017971 0.73 TSHR (0.50) TSHRKMT2AMEN1LMNAKDM4E
Dimethyl Succinate SCHEMBL28054469 0.71 TSHR (1.00) TSHRKMT2AMEN1LMNAKDM4E
Dimethyl Succinate SCHEMBL10213 0.71 TSHR (1.00) TSHRKMT2AMEN1LMNAKDM4E
SCHEMBL1979159 0.70 TSHR (0.65) TSHRKMT2AMEN1LMNAKDM4E
SCHEMBL2914094 0.69 TSHR (0.62) TSHRKMT2AMEN1LMNAKDM4E
Dimethyl Succinate SCHEMBL29248752 0.68 TSHR (0.93) TSHRKMT2AMEN1LMNAKDM4E
Dimethyl Succinate SCHEMBL7778900 0.68 TSHR (0.93) TSHRKMT2AMEN1LMNAKDM4E
Dimethyl Succinate SCHEMBL29824778 0.68 TSHR (0.93) TSHRKMT2AMEN1LMNAKDM4E
Dimethyl Succinate SCHEMBL16798755 0.68 TSHR (0.93) TSHRKMT2AMEN1LMNAKDM4E
Dimethyl Succinate SCHEMBL31389405 0.68 TSHR (0.93) TSHRKMT2AMEN1LMNAKDM4E

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-7527912-B2 Photoacid generators, resist compositions, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2009-05-05 US disclosed
US-20080085469-A1 Novel photoacid generators, resist compositions, and patterning process SHIN-ETSU CHEMICAL CO., LTD. 2008-04-10 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-20080085469-A1 Novel photoacid generators, resist compositions, and patterning process RER1, SCO2, ASIC3 TSHR 1699/4885KMT2A 1964/4885MEN1 3960/4885

“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.