SCHEMBL991522

SCHEMBL991522

CC(C)S(=O)(=O)n1c(N)nc2ccc(I)cc21

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PI4KB Q9UBF8 1/20 0.57
MAPK14 Q16539 19/20 0.56
CYP3A4 P08684 10/20 0.56

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
SCHEMBL18058952 0.84 PI4KB (0.58) PI4KBMAPK14CYP3A4
SCHEMBL4841714 0.83 MAPK14 (0.41) PI4KBMAPK14CYP3A4
SCHEMBL19840303 0.81 MAPK14 (0.55) PI4KBMAPK14CYP3A4
SCHEMBL4830269 0.81 PI4KB (0.55) PI4KBMAPK14CYP3A4
SCHEMBL989419 0.80 MAPK14 (0.49) PI4KBMAPK14CYP3A4
SCHEMBL5773665 0.80 PI4KB (0.54) PI4KBMAPK14CYP3A4
SCHEMBL988637 0.80 PI4KB (0.57) PI4KBMAPK14CYP3A4
SCHEMBL4830340 0.78 MAPK14 (0.39) PI4KBMAPK14CYP3A4
SCHEMBL14247717 0.77 MAPK14 (0.45) PI4KBMAPK14CYP3A4
SCHEMBL11076745 0.77 PI4KB (0.62) PI4KBMAPK14CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7863310-B2 Kinase inhibitors ELI LILLY AND COMPANY (US) 2011-01-04 US disclosed
US-20080227839-A1 Kinase Inhibitors ELI LILLY AND COMPANY 2008-09-18 US disclosed
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 (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-20050272791-A1 Benzimidazoles and benzothiazoles as inhibitors of map kinase MAP3K8, MAPK8, MAPK1 PI4KB 282/4885MAPK14 10/4885CYP3A4 2862/4885
US-20080227839-A1 Kinase Inhibitors ABL1, MAP3K20, MAP3K19 PI4KB 62/4885MAPK14 341/4885CYP3A4 3973/4885

“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.