SCHEMBL2435600

SCHEMBL2435600

O=S(=O)(O)F.O=S(=O)(O)F.O=S(=O)(O)F.O=S(=O)(O)F.O=S(=O)(O)F.O=S(=O)([O-])F.c1ccc([S+](c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
FAAH O00519 1/20 0.35
PRSS1 P07477 1/20 0.35
PRSS2 P07478 1/20 0.35
ELANE P08246 1/20 0.35
PRTN3 P24158 1/20 0.35
PRSS3 P35030 1/20 0.35
POLB P06746 2/20 0.35
CYP2D6 P10635 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
SNCA P37840 1/20 0.33
SRC P12931 1/20 0.32
HTR6 P50406 1/20 0.32
PTGS2 P35354 1/20 0.32
CA2 P00918 3/20 0.31
CA12 O43570 2/20 0.31
CA9 Q16790 2/20 0.31
ALDH1A1 P00352 1/20 0.31
APOBEC3G Q9HC16 2/20 0.31

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
SCHEMBL2679092 1.00 TSHR (0.39) TSHRSMN1; SMN2FAAHPRSS1PRSS2
SCHEMBL1476157 0.93 FAAH (0.39) TSHRSMN1; SMN2FAAHPRSS1PRSS2
SCHEMBL7914149 0.93 FAAH (0.39) TSHRSMN1; SMN2FAAHPRSS1PRSS2
SCHEMBL561475 0.93 FAAH (0.39) TSHRSMN1; SMN2FAAHPRSS1PRSS2
SCHEMBL5078707 0.93 FAAH (0.39) TSHRSMN1; SMN2FAAHPRSS1PRSS2
SCHEMBL2283421 0.93 FAAH (0.39) TSHRSMN1; SMN2FAAHPRSS1PRSS2
SCHEMBL7102917 0.93 FAAH (0.39) TSHRSMN1; SMN2FAAHPRSS1PRSS2
SCHEMBL7038440 0.89 CA12 (0.39) TSHRSMN1; SMN2CYP2D6TDP1CA2
Sulfuric Acid SCHEMBL5798237 0.89 TSHR (0.44) TSHRSMN1; SMN2POLBCYP2D6TDP1
SCHEMBL1477345 0.85 ALDH1A1 (0.40) TDP1CA2ALDH1A1CA1KMT2A

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
EP-2196462-B1 Polymerizable compound, lactone-containing compound, method for manufacturing lactone-containing compound and polymer compound obtained by polymerizing the polymerizable compound FUJIFILM CORP (JP) 2011-09-28 EP disclosed
US-20100152400-A1 POLYMERIZABLE COMPOUND, LACTONE-CONTAINING COMPOUND, METHOD FOR MANUFACTURING LACTONE-CONTAINING COMPOUND AND POLYMER COMPOUND OBTAINED BY POLYMERIZING THE POLYMERIZABLE COMPOUND FUJIFILM CORPORATION (JP) 2010-06-17 US disclosed
EP-2196462-A1 Polymerizable compound, lactone-containing compound, method for manufacturing lactone-containing compound and polymer compound obtained by polymerizing the polymerizable compound Fujifilm Corporation (JP) 2010-06-16 EP 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-20100152400-A1 POLYMERIZABLE COMPOUND, LACTONE-CONTAINING COMPOUND, METHOD FOR MANUFACTURING LACTONE-CONTAINING COMPOUND AND POLYMER COMPOUND OBTAINED BY POLYMERIZING THE POLYMERIZABLE COMPOUND CCNO, DCXR, FGB TSHR 3045/4885SMN1; SMN2 4396/4885FAAH 1491/4885

“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.