SCHEMBL4830292

SCHEMBL4830292

Cc1ccc(S(=O)(=O)C(N)c2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY2R P49146 1/20 0.49
CYP2D6 P10635 2/20 0.48
MAPK1 P28482 1/20 0.48
CA12 O43570 4/20 0.45
CA9 Q16790 4/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA3 P07451 1/20 0.45
CA6 P23280 1/20 0.45
CA5A P35218 1/20 0.45
CA7 P43166 1/20 0.45
CA5B Q9Y2D0 1/20 0.45
BCHE P06276 1/20 0.45
ACHE P22303 1/20 0.45
GAA P10253 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HTT P42858 1/20 0.43
ALDH1A1 P00352 3/20 0.42
CYP1A2 P05177 2/20 0.42
CYP3A4 P08684 2/20 0.42

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
SCHEMBL7637220 0.86 GBA1 (0.47) CA12CA9CA1CA2CA3
Indene SCHEMBL3433213 0.83 NPY2R (0.38) NPY2RCYP2D6MAPK1CA12CA9
SCHEMBL212443 0.83 KMT2A (0.46) CA12CA9CA1CA2CA6
SCHEMBL6127490 0.82 ACHE (0.47) CA12CA9CA1CA2CA3
SCHEMBL6914203 0.79 NPY2R (0.50) NPY2RCYP2D6MAPK1CA12CA9
SCHEMBL11689700 0.79 NPY2R (0.50) NPY2RCYP2D6MAPK1CA12CA9
SCHEMBL12373175 0.79 NPY2R (0.50) NPY2RCYP2D6MAPK1CA12CA9
SCHEMBL754520 0.79 NPY2R (0.50) NPY2RCYP2D6MAPK1CA12CA9
SCHEMBL4983476 0.77 CYP2D6 (0.51) NPY2RCYP2D6MAPK1CA12CA9
SCHEMBL7082810 0.77 CA12 (0.39) CYP2D6MAPK1CA12CA9CA1

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-7320995-B2 Benzimidazoles and benzothiazoles as inhibitors of map kinase ELI LILLY AND COMPANY (US) 2008-01-22 US disclosed
EP-1720862-A1 KINASE INHIBITORS ELI LILLY AND COMPANY (US) 2006-11-15 EP disclosed
EP-1554272-B1 BENZIMIDAZOLES AND BENZOTHIAZOLES AS INHIBITORS OF MAP KINASE LILLY CO ELI (US) 2006-10-25 EP disclosed
US-20050272791-A1 Benzimidazoles and benzothiazoles as inhibitors of map kinase EIL LILLY AND COMPANY (US) 2005-12-08 US disclosed
WO-2005080380-A1 KINASE INHIBITORS ELI LILLY AND COMPANY (US) 2005-09-01 WO disclosed
EP-1554272-A1 BENZIMIDAZOLES AND BENZOTHIAZOLES AS INHIBITORS OF MAP KINASE ELI LILLY AND COMPANY (US) 2005-07-20 EP disclosed
WO-2004014900-A1 BENZIMIDAZOLES AND BENZOTHIAZOLES AS INHIBITORS OF MAP KINASE ELI LILLY AND COMPANY (US) 2004-02-19 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-20050272791-A1 Benzimidazoles and benzothiazoles as inhibitors of map kinase MAP3K8, MAPK8, MAPK1 NPY2R 3725/4885CYP2D6 2662/4885MAPK1 3/4885

“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.