SCHEMBL3100173

SCHEMBL3100173

CCOC(=O)c1cc(-c2ccc(F)cc2)n(-c2ccc(S(N)(=O)=O)cc2)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 7/20 1.00
CA9 Q16790 4/20 0.84
PTGS2 P35354 6/20 0.79
SMN1; SMN2 Q16637 1/20 0.63
CA1 P00915 1/20 0.63
CA2 P00918 1/20 0.63
CA4 P22748 1/20 0.63
PTGS1 P23219 1/20 0.61

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
SCHEMBL6343758 0.92 CA9 (1.00) CHRNA7CA9PTGS2SMN1; SMN2CA1
SCHEMBL7627415 0.91 CHRNA7 (0.83) CHRNA7CA9PTGS2PTGS1
SCHEMBL6342008 0.90 CHRNA7 (1.00) CHRNA7CA9PTGS2SMN1; SMN2
SCHEMBL9941851 0.89 CA9 (1.00) CHRNA7CA9PTGS2SMN1; SMN2CA1
SCHEMBL6342214 0.88 PTGS2 (1.00) CHRNA7CA9PTGS2SMN1; SMN2PTGS1
SCHEMBL9206474 0.87 CHRNA7 (0.77) CHRNA7CA9PTGS2
SCHEMBL9203679 0.87 CHRNA7 (0.77) CHRNA7CA9PTGS2SMN1; SMN2PTGS1
SCHEMBL9212244 0.84 CHRNA7 (0.72) CHRNA7CA9PTGS2
SCHEMBL9203093 0.84 CHRNA7 (0.72) CHRNA7CA9PTGS2
SCHEMBL6344501 0.83 PTGS2 (0.76) CHRNA7CA9PTGS2SMN1; SMN2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100256357-A1 HETEROCYCLES USEFUL AS INHIBITORS OF CARBONIC ANHYDRASE AGOURON PHARMACEUTICALS, INC. 2010-10-07 US disclosed
US-20100256357-A1 HETEROCYCLES USEFUL AS INHIBITORS OF CARBONIC ANHYDRASE AGOURON PHARMACEUTICALS, INC. 2010-10-07 US disclosed
US-20100256357-A1 HETEROCYCLES USEFUL AS INHIBITORS OF CARBONIC ANHYDRASE AGOURON PHARMACEUTICALS, INC. 2010-10-07 US disclosed
EP-2051966-A2 HETEROCYCLES USEFUL AS INHIBITORS OF CARBONIC ANHYDRASE Pfizer Products Inc. (US) 2009-04-29 EP disclosed
WO-2008017932-A2 HETEROCYCLES USEFUL AS INHIBITORS OF CARBONIC ANHYDRASE PFIZER PRODUCTS INC. (US) 2008-02-14 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 (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-20100256357-A1 HETEROCYCLES USEFUL AS INHIBITORS OF CARBONIC ANHYDRASE CA2, CA7, CA9 CHRNA7 3165/4885CA9 3/4885PTGS2 47/4885

“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.