SCHEMBL6741904

SCHEMBL6741904

CCCCCCCCCCCCOc1ccc(S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)c2ccc(OCCCCCCCCCCCC)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.53
CA12 O43570 3/20 0.53
CA1 P00915 3/20 0.53
CA2 P00918 3/20 0.53
CA9 Q16790 3/20 0.53
CA7 P43166 2/20 0.53
NR5A1 Q13285 1/20 0.51
TP53 P04637 1/20 0.50
PLA2G4B P0C869 2/20 0.49
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
RARB P10826 3/20 0.47
MMP3 P08254 1/20 0.46
LTA4H P09960 1/20 0.45
MMP1 P03956 2/20 0.45
ADAMTS4 O75173 1/20 0.45
MMP2 P08253 1/20 0.45
MMP13 P45452 1/20 0.45
MMP14 P50281 1/20 0.45
ADAMTS5 Q9UNA0 1/20 0.45

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
SCHEMBL6743900 1.00 TSHR (0.53) TSHRCA12CA1CA2CA9
SCHEMBL6736787 1.00 TSHR (0.53) TSHRCA12CA1CA2CA9
SCHEMBL6741875 1.00 TSHR (0.53) TSHRCA12CA1CA2CA9
SCHEMBL6742374 1.00 TSHR (0.53) TSHRCA12CA1CA2CA9
SCHEMBL6743983 1.00 TSHR (0.53) TSHRCA12CA1CA2CA9
SCHEMBL383894 1.00 TSHR (0.53) TSHRCA12CA1CA2CA9
SCHEMBL6741656 0.99 TSHR (0.54) TSHRCA12CA1CA2CA9
SCHEMBL6739744 0.96 CA12 (0.57) TSHRCA12CA1CA2CA9
SCHEMBL6736717 0.95 TSHR (0.48) TSHRCA12CA1CA2CA9
SCHEMBL6736676 0.95 TSHR (0.49) TSHRCA12CA1CA2CA9

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-6689530-B2 ULTRAVIOLET LITHOGRAPHY MICROFABRICATION WITH IMPROVED RESOLUTION AND PATTERN PROFILE AFTER DEVELOPMENT SHIN-ETSU CHEMICAL CO., LTD. (JP) 2004-02-10 US disclosed
US-20030180653-A1 Novel sulfonyldiazomethanes, photoacid generations, resist compositions, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2003-09-25 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-20030180653-A1 Novel sulfonyldiazomethanes, photoacid generations, resist compositions, and patterning process CACNA1A, KCNA1, POLL TSHR 3831/4885CA12 2936/4885CA1 3283/4885

“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.