SCHEMBL965057

SCHEMBL965057

CCCCN(C(=O)O)S(=O)(=O)CCc1c(C)nn(C)c1-n1ccc2cc(Cl)ccc21

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.34
OXER1 Q8TDS5 5/20 0.33
MAPK8 P45983 3/20 0.32
LMNA P02545 2/20 0.32
MAPK9 P45984 2/20 0.32
MAPK10 P53779 2/20 0.32
SLC6A2 P23975 1/20 0.32
CRHR1 P34998 2/20 0.31
MAP4K4 O95819 1/20 0.31
CSF1R P07333 1/20 0.31
PIM1 P11309 1/20 0.31
CLK2 P49760 1/20 0.31
MAP4K2 Q12851 1/20 0.31
MINK1 Q8N4C8 1/20 0.31
CLK4 Q9HAZ1 1/20 0.31
MAP4K5 Q9Y4K4 1/20 0.31
PHGDH O43175 3/20 0.31
PPARG P37231 1/20 0.31
PPARD Q03181 1/20 0.31

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
SCHEMBL966868 0.95 SLC6A2 (0.35) PTGDR2OXER1MAPK8LMNAMAPK9
SCHEMBL966069 0.94 OXER1 (0.34) PTGDR2OXER1MAPK8LMNAMAPK9
SCHEMBL964724 0.93 KMO (0.33) PTGDR2OXER1MAPK8LMNAMAPK9
SCHEMBL966098 0.93 OXER1 (0.34) PTGDR2OXER1MAPK8LMNAMAPK9
SCHEMBL967888 0.91 MAPK8 (0.34) PTGDR2OXER1MAPK8LMNAMAPK9
SCHEMBL964535 0.90 OXER1 (0.33) PTGDR2OXER1LMNA
SCHEMBL964567 0.90 PTGDR2 (0.35) PTGDR2LMNA
SCHEMBL962091 0.89 PHGDH (0.34) PTGDR2MAPK8LMNAPIM1PHGDH
SCHEMBL962752 0.89 PTGDR2 (0.31) PTGDR2OXER1LMNAPHGDHPPARG
SCHEMBL964410 0.88 KMO (0.34) PTGDR2OXER1MAPK8LMNAMAPK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-01-13 US 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-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA PPARA, PPARD, PPARG PTGDR2 295/4885OXER1 877/4885MAPK8 2186/4885

“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.