SCHEMBL5653047

SCHEMBL5653047

O=S(=O)(O)NCc1ccc(F)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 4/20 0.54
CA2 P00918 3/20 0.54
CA1 P00915 2/20 0.54
CA12 O43570 3/20 0.51
CA7 P43166 2/20 0.51
CA14 Q9ULX7 2/20 0.51
PLA2G1B P04054 1/20 0.48
ATG4B Q9Y4P1 1/20 0.48
CXCR4 P61073 1/20 0.48
NSD2 O96028 2/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
CYP19A1 P11511 1/20 0.47
LMNA P02545 2/20 0.47
CHRM2 P08172 1/20 0.47
CYP1A2 P05177 1/20 0.46
POLB P06746 1/20 0.46
CYP2C9 P11712 1/20 0.46
HPGD P15428 1/20 0.46
CYP2C19 P33261 1/20 0.46

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
SCHEMBL29074465 0.79 KMT2A (0.59) CA9CA12KMT2AMEN1CYP19A1
SCHEMBL22690487 0.79 CA2 (0.56) CA9CA2CA1CA12CA7
SCHEMBL20534987 0.79 CA12 (0.51) CA9CA2CA1CA12CA7
SCHEMBL2100494 0.79 KMT2A (0.59) CA9CA2CA1CA12CA7
SCHEMBL3368849 0.79 CA2 (0.54) CA9CA2CA1CA12CA7
SCHEMBL14380636 0.79 CA2 (0.66) CA9CA2CA1CA12CA7
SCHEMBL15672903 0.79 CA9 (0.54) CA9CA2CA1CA12CA7
SCHEMBL229506 0.78 CA12 (0.68) CA9CA2CA1CA12CA7
Water SCHEMBL3952740 0.77 CA12 (0.65) CA9CA2CA1CA12CA7
SCHEMBL10953887 0.77 CA12 (0.65) CA9CA2CA1CA12CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100432070-C Novel sulfamides and their use as endothelin receptor antagonists ACTELION PHARMACEUTICALS LTD (CH) 2008-11-12 CN claimed
EP-1693372-A1 Novel Sulfamides and their use as endothelin receptor antagonists Actelion Pharmaceuticals Ltd. (CH) 2006-08-23 EP claimed
US-7094781-B2 Sulfamides and their use as endothelin receptor antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2006-08-22 US claimed
EP-1345920-B1 NOVEL SULFAMIDES AND THEIR USE AS ENDOTHELIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2006-04-12 EP claimed
CN-1524079-A Novel sulfonamides and their use as endothelin receptor antagonists ������˹ҩƷ��˾ 2004-08-25 CN claimed
US-20040077670-A1 Novel sulfamides and their use as endothelin receptor antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2004-04-22 US claimed
EP-1345920-A1 NOVEL SULFAMIDES AND THEIR USE AS ENDOTHELIN RECEPTOR ANTAGONISTS Actelion Pharmaceuticals Ltd. (CH) 2003-09-24 EP claimed
WO-2002053557-A1 NOVEL SULFAMIDES AND THEIR USE AS ENDOTHELIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2002-07-11 WO claimed

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-20040077670-A1 Novel sulfamides and their use as endothelin receptor antagonists EDNRA, EDNRB, ECE1 CA9 2833/4885CA2 1613/4885CA1 4222/4885

“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.