SCHEMBL3103020

SCHEMBL3103020

CCOC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cn2)n1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 9/20 0.55
CHRNA7 P36544 3/20 0.53
CA1 P00915 4/20 0.43
CA2 P00918 4/20 0.43
CA12 O43570 4/20 0.43
PTGS2 P35354 2/20 0.41
SLC34A1 Q06495 1/20 0.41
CA4 P22748 2/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
GAA P10253 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL3112808 0.84 PTGS2 (0.46) CA9CHRNA7CA1CA2CA12
SCHEMBL3101600 0.83 CA9 (0.72) CA9CHRNA7CA1CA2CA12
SCHEMBL3107305 0.83 CHRNA7 (0.44) CA9CHRNA7CA1CA2CA12
SCHEMBL13757336 0.83 MAPT (0.47) CA9SLC34A1KMT2AMEN1GAA
SCHEMBL3106812 0.81 CHRNA7 (0.42) CA9CHRNA7CA1CA2CA12
SCHEMBL3111574 0.81 BAZ2B (0.45) CA9CHRNA7CA1CA2CA12
SCHEMBL15529788 0.81 SLC34A1 (0.43) SLC34A1KMT2AMEN1GAAKDM4E
SCHEMBL14292899 0.79 SLC34A1 (0.42) SLC34A1KMT2AMEN1GAAKDM4E
SCHEMBL3096202 0.79 CA9 (0.57) CA9CHRNA7CA1CA2CA12
SCHEMBL3100167 0.77 L3MBTL1 (0.47) CA9CHRNA7CA1CA2PTGS2

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 CA9 3/4885CHRNA7 3165/4885CA1 7/4885

“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.