Sugi Predict

Sugi Predict / Compounds / SCHEMBL14353045

SCHEMBL14353045

SCHEMBL14353045

Cc1ccc(S(=O)(=O)OCC(O)(C(F)(F)F)C(F)(F)F)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ NPSR1 Q6W5P4 3/20 0.42
▸ HTT P42858 1/20 0.42
▸ STAT3 P40763 2/20 0.42
▸ RORC P51449 1/20 0.40
▸ GAA P10253 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ CA2 P00918 2/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CTDSP1 Q9GZU7 1/20 0.37
▸ SIRT5 Q9NXA8 1/20 0.37
▸ CA1 P00915 1/20 0.37
▸ MMP1 P03956 1/20 0.37
▸ MMP2 P08253 1/20 0.37
▸ MMP9 P14780 1/20 0.37
▸ MMP8 P22894 1/20 0.37
▸ MMP13 P45452 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37

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
SCHEMBL476769 0.87 ALDH1A1 (0.47) ALDH1A1MEN1KMT2ANPSR1STAT3
SCHEMBL30156542 0.86 ALDH1A1 (0.46) ALDH1A1MEN1KMT2ANPSR1STAT3
SCHEMBL14460714 0.86 ALDH1A1 (0.46) ALDH1A1MEN1KMT2ANPSR1STAT3
SCHEMBL29658223 0.86 ALDH1A1 (0.46) ALDH1A1MEN1KMT2ANPSR1STAT3
SCHEMBL4128235 0.84 ALDH1A1 (0.41) ALDH1A1MEN1KMT2ANPSR1HTT
SCHEMBL16930312 0.84 STAT3 (0.42) ALDH1A1MEN1KMT2ASTAT3GAA
SCHEMBL19476713 0.84 ALDH1A1 (0.44) ALDH1A1MEN1KMT2ASTAT3GAA
SCHEMBL2533175 0.83 GAA (0.41) ALDH1A1MEN1KMT2ASTAT3RORC
SCHEMBL19436459 0.83 GAA (0.43) ALDH1A1MEN1KMT2ASTAT3GAA
SCHEMBL68796 0.83 GAA (0.43) ALDH1A1MEN1KMT2ASTAT3GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200247926-A1 POLYMERIZABLE MONOMER, POLYMER COMPOUND FOR CONDUCTIVE POLYMER, AND METHOD FOR PRODUCING THE POLYMER COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-08-06 — — US disclosed
US-20130005997-A1 PREPARATION OF 2,2-BIS (FLUOROALKYL) OXIRANE AND PREPARATION OF PHOTOACID GENERATOR THEREFROM SHIN-ETSU CHEMICAL CO., LTD. (JP) 2013-01-03 — — US disclosed
US-20130005997-A1 PREPARATION OF 2,2-BIS (FLUOROALKYL) OXIRANE AND PREPARATION OF PHOTOACID GENERATOR THEREFROM SHIN-ETSU CHEMICAL CO., LTD. (JP) 2013-01-03 — — 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 (2 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-20200247926-A1 POLYMERIZABLE MONOMER, POLYMER COMPOUND FOR CONDUCTIVE POLYMER, AND METHOD FOR PRODUCING THE POLYMER COMPOUND HCN4, HCN2, HCN3 ALDH1A1 2526/4885MEN1 1397/4885KMT2A 971/4885
US-20130005997-A1 PREPARATION OF 2,2-BIS (FLUOROALKYL) OXIRANE AND PREPARATION OF PHOTOACID GENERATOR THEREFROM OXGR1, FFAR2, OXER1 ALDH1A1 148/4885MEN1 4054/4885KMT2A 1342/4885

“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.