SCHEMBL6137897

SCHEMBL6137897

NS(=O)(=O)c1cc(-c2nnc(S)o2)c(Nc2ccc(I)cc2)cc1F

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 7/20 0.41
CA2 P00918 7/20 0.41
CA12 O43570 6/20 0.41
CA9 Q16790 6/20 0.41
SOS1 Q07889 3/20 0.37
SPHK2 Q9NRA0 1/20 0.31
LMNA P02545 1/20 0.31
TET2 Q6N021 1/20 0.31
F10 P00742 1/20 0.31
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
TYK2 P29597 1/20 0.31
JAK3 P52333 1/20 0.31
CDK1 P06493 1/20 0.30
CDK2 P24941 1/20 0.30
MAOB P27338 1/20 0.30

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
SCHEMBL6138146 0.96 CA1 (0.39) CA1CA2CA12CA9SOS1
SCHEMBL6137885 0.88 CA1 (0.42) CA1CA2CA12CA9SOS1
SCHEMBL6137604 0.86 CA2 (0.39) CA1CA2CA12CA9MAOB
SCHEMBL6137948 0.86 IDO1 (0.39) CA1CA2CA12CA9MAOB
SCHEMBL6138001 0.84 CA1 (0.40) CA1CA2CA12CA9SOS1
SCHEMBL6138018 0.79 SOS1 (0.37) CA1CA2CA12CA9SOS1
SCHEMBL6137904 0.76 SOS1 (0.38) CA1CA2CA12CA9SOS1
SCHEMBL6137926 0.75 KDM4E (0.39) CA1CA2CA12CA9SOS1
SCHEMBL6138026 0.75 SOS1 (0.38) CA1CA2CA12CA9SOS1
SCHEMBL6138121 0.75 SOS1 (0.38) CA1CA2CA12CA9SOS1

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
EP-1144394-B1 1-HETEROCYCLE SUBSTITUTED DIARYLAMINES WARNER LAMBERT CO (US) 2005-08-24 EP disclosed
US-6545030-B1 Treating proliferative diseases, the sequelae of a stroke or heart failure, xenograft rejection, osteoarthritis, HIV, rheumatoid arthritis, cystic fibrosis, hepatomegaly, shock,cardiomegaly, Alzheimer's disease, diabetes WARNER-LAMBERT COMPANY 2003-04-08 US disclosed
US-20030004193-A1 1-Heterocycle substituted diarylamines BARRETT STEPHEN DOUGLAS (US) 2003-01-02 US disclosed
EP-1202732-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-05-08 EP disclosed
EP-1144394-A1 1-HETEROCYCLE SUBSTITUTED DIARYLAMINES WARNER-LAMBERT COMPANY (US) 2001-10-17 EP disclosed
WO-2001005391-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-01-25 WO disclosed
WO-2000042029-A1 1-HETEROCYCLE SUBSTITUTED DIARYLAMINES WARNER-LAMBERT COMPANY (US) 2000-07-20 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-20030004193-A1 1-Heterocycle substituted diarylamines IDH3A, CCNA1, HCCS CA1 842/4885CA2 3273/4885CA12 2676/4885

“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.