SCHEMBL4880923

SCHEMBL4880923

CN(C)S(=O)(=O)n1c(N)nc2ccc(C(=O)C(=O)c3ccccc3)cc21

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PI4KB Q9UBF8 1/20 0.53
MAPK14 Q16539 4/20 0.48
SMN1; SMN2 Q16637 4/20 0.44
NOD1 Q9Y239 5/20 0.41
RAB9A P51151 3/20 0.41
CXCL8 P10145 3/20 0.41
NPC1 O15118 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
KDM4E B2RXH2 1/20 0.38
PKM P14618 1/20 0.38
GAA P10253 1/20 0.38
NOD2 Q9HC29 1/20 0.38
ACSS2 Q9NR19 4/20 0.38
CYP3A4 P08684 1/20 0.38
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38

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
SCHEMBL11148552 0.91 PI4KB (0.53) PI4KBMAPK14SMN1; SMN2NOD1RAB9A
SCHEMBL11145834 0.88 PI4KB (0.51) PI4KBMAPK14SMN1; SMN2NOD1RAB9A
SCHEMBL11262610 0.88 PI4KB (0.48) PI4KBMAPK14SMN1; SMN2NOD1RAB9A
SCHEMBL11144960 0.87 PI4KB (0.52) PI4KBMAPK14SMN1; SMN2NOD1RAB9A
SCHEMBL11147024 0.86 PI4KB (0.51) PI4KBMAPK14SMN1; SMN2NOD1RAB9A
SCHEMBL11147028 0.86 PI4KB (0.51) PI4KBMAPK14SMN1; SMN2NOD1RAB9A
SCHEMBL11152374 0.85 PI4KB (0.48) PI4KBMAPK14SMN1; SMN2NOD1RAB9A
SCHEMBL11246875 0.85 PI4KB (0.46) PI4KBMAPK14SMN1; SMN2NOD1RAB9A
SCHEMBL11149868 0.84 PI4KB (0.49) PI4KBMAPK14SMN1; SMN2NOD1RAB9A
SCHEMBL11148060 0.84 PI4KB (0.49) PI4KBMAPK14SMN1; SMN2NOD1RAB9A

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-7320995-B2 Benzimidazoles and benzothiazoles as inhibitors of map kinase ELI LILLY AND COMPANY (US) 2008-01-22 US 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
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 PI4KB 282/4885MAPK14 10/4885SMN1; SMN2 4631/4885

“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.