SCHEMBL967852

SCHEMBL967852

CCCCCNS(=O)(=O)NC(=O)Cc1c(C)nn(C)c1-n1ccc2cc(Cl)ccc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 6/20 0.34
CNR2 P34972 5/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
PTGS2 P35354 2/20 0.33
CRHR1 P34998 2/20 0.32
MAPK8 P45983 1/20 0.32
MAPK9 P45984 1/20 0.32
MAPK10 P53779 1/20 0.32
RAB9A P51151 1/20 0.32
PSEN1 P49768 1/20 0.32
PSEN2 P49810 1/20 0.32
APH1B Q8WW43 1/20 0.32
NCSTN Q92542 1/20 0.32
APH1A Q96BI3 1/20 0.32
PSENEN Q9NZ42 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PPARG P37231 1/20 0.32

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
SCHEMBL962963 0.92 PPARG (0.36) CNR1CNR2MAPK8PPARG
SCHEMBL965763 0.88 PPARG (0.41) PTGDR2MAPK8MAPK9MAPK10PPARG
SCHEMBL962013 0.87 GSK3B (0.36) ALDH1A1PPARGHPGD
SCHEMBL965519 0.84 PPARG (0.37) CNR1CNR2PTGDR2CRHR1PSEN1
SCHEMBL965522 0.84 PPARG (0.37) CNR1CNR2PTGDR2CRHR1PSEN1
SCHEMBL965582 0.81 MAPT (0.36) CNR1CNR2PTGDR2CRHR1HTT
SCHEMBL965585 0.81 MAPT (0.36) CNR1CNR2PTGDR2CRHR1HTT
SCHEMBL964454 0.80 PPARG (0.42) PPARG
SCHEMBL966732 0.80 PPARG (0.47) PPARG
SCHEMBL965653 0.79 NPY5R (0.33) CNR1CNR2PTGDR2CRHR1

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 4 patents. 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
EP-2118066-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA Takeda Pharmaceutical Company Limited (JP) 2009-11-18 EP disclosed
WO-2008099794-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-08-21 WO disclosed
US-20080194617-A1 Fused ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-08-14 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 (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-20080194617-A1 Fused ring compound SLC5A1, SLC5A2, GPR119 CNR1 1414/4885CNR2 2360/4885PTGDR2 2740/4885
US-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA PPARA, PPARD, PPARG CNR1 153/4885CNR2 290/4885PTGDR2 295/4885

“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.