SCHEMBL5861574

SCHEMBL5861574

CCCCCCOc1ccc(CCOC)cc1S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)c1cc(CCOC)ccc1OCCCCCC

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
S1PR3 Q99500 6/20 0.39
SMPD1 P17405 4/20 0.39
S1PR1 P21453 6/20 0.39
S1PR2 O95136 5/20 0.39
LPAR2 Q9HBW0 5/20 0.39
CNR2 P34972 2/20 0.38
PTPN1 P18031 1/20 0.37
PTPN6 P29350 1/20 0.37
PTPN11 Q06124 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
SCHEMBL5861993 0.89 S1PR3 (0.42) THRATHRBS1PR3SMPD1S1PR1
SCHEMBL5862958 0.89 S1PR3 (0.42) THRATHRBS1PR3SMPD1S1PR1
SCHEMBL5862337 0.89 S1PR3 (0.42) THRATHRBS1PR3SMPD1S1PR1
SCHEMBL5861981 0.89 S1PR3 (0.42) THRATHRBS1PR3SMPD1S1PR1
SCHEMBL5862538 0.87 S1PR3 (0.40) THRATHRBS1PR3SMPD1S1PR1
SCHEMBL5861533 0.83 ATM (0.37) THRATHRBS1PR3PTPN1PTPN6
SCHEMBL5843349 0.82 THRA (0.45) THRATHRBS1PR3PTPN11
SCHEMBL5844543 0.82 THRA (0.45) THRATHRBS1PR3PTPN11
SCHEMBL5862976 0.82 POLB (0.43) THRATHRBS1PR3SMPD1PTPN11
SCHEMBL5861561 0.82 POLB (0.43) THRATHRBS1PR3SMPD1PTPN11

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-7109311-B2 Sulfonyldiazomethanes, photoacid generators, resist compositions, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2006-09-19 US disclosed
US-20040167322-A1 Novel sulfonyldiazomethanes, photoacid generators, resist compositions, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2004-08-26 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-20040167322-A1 Novel sulfonyldiazomethanes, photoacid generators, resist compositions, and patterning process POLL, VEGFA, PIM3 THRA 2769/4885THRB 3554/4885S1PR3 2134/4885

“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.