SCHEMBL2484124

SCHEMBL2484124

O=S(=O)(O)c1ccc(CCCCC(F)(F)C(F)(F)F)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 9/20 0.44
CA1 P00915 4/20 0.44
PTPN2 P17706 1/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39
PTPN11 Q06124 1/20 0.39
MGLL Q99685 2/20 0.38
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TSHR P16473 2/20 0.36
ALDH1A1 P00352 1/20 0.36
NT5E P21589 1/20 0.36
FAAH O00519 1/20 0.36
CA12 O43570 1/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35
CA5A P35218 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35

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
SCHEMBL775755 0.88 LMNA (0.41) CA2CA1LMNASMN1; SMN2TSHR
SCHEMBL20164792 0.87 CA2 (0.45) CA2CA1PTPN2PTPN1PTPN6
SCHEMBL20560555 0.83 CA2 (0.43) CA2CA1LMNASMN1; SMN2
SCHEMBL30446884 0.82 CA2 (0.57) CA2CA1MGLLLMNASMN1; SMN2
SCHEMBL776683 0.81 LMNA (0.45) CA2CA1PTPN2PTPN1PTPN6
SCHEMBL10377765 0.79 CA1 (0.41) CA2CA1LMNASMN1; SMN2TSHR
SCHEMBL778771 0.78 LMNA (0.43) CA2CA1LMNASMN1; SMN2TSHR
SCHEMBL778371 0.78 TSHR (0.47) CA2CA1LMNASMN1; SMN2TSHR
SCHEMBL4333544 0.78 CA2 (0.49) CA2CA1MGLLLMNASMN1; SMN2
SCHEMBL1806460 0.75 CA2 (0.70) CA2CA1MGLLLMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240132432-A1 FLUORINE-CONTAINING PILLARARENE KYOTO UNIVERSITY (JP) 2024-04-25 US disclosed
EP-4357330-A1 FLUORINE-CONTAINING PILLARARENE Kyoto University (JP) 2024-04-24 EP disclosed
WO-2022265084-A1 FLUORINE-CONTAINING PILLARARENE 国立大学法人京都大学 2022-12-22 WO disclosed
US-8513162-B2 Halogen-containing organosulfur compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-08-20 US disclosed
US-20110257226-A1 HALOGEN-CONTAINING ORGANOSULFUR COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-10-20 US disclosed
EP-2376450-A1 HALOGEN-CONTAINING ORGANOSULFUR COMPOUNDS AND USE THEREOF FOR CONTROLLING ARTHROPOD PEST Sumitomo Chemical Company, Limited (JP) 2011-10-19 EP disclosed
WO-2010074327-A1 HALOGEN-CONTAINING ORGANOSULFUR COMPOUNDS AND USE THEREOF FOR CONTROLLING ARTHROPOD PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-07-01 WO 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-20240132432-A1 FLUORINE-CONTAINING PILLARARENE FOXK1, FXR1, AFF1 CA2 4783/4885CA1 2415/4885PTPN2 3580/4885
US-20110257226-A1 HALOGEN-CONTAINING ORGANOSULFUR COMPOUND AND USE THEREOF C1S, C5, L3MBTL3 CA2 3772/4885CA1 4180/4885PTPN2 3044/4885

“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.