SCHEMBL1022157

SCHEMBL1022157

CCCC1=C(c2ccc(F)c(F)c2)C(=O)CC1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 13/20 0.51
PTGS1 P23219 10/20 0.51
PDE5A O76074 1/20 0.36
HSD17B1 P14061 1/20 0.33
PGR P06401 2/20 0.32
HRH3 Q9Y5N1 1/20 0.32
GCGR P47871 1/20 0.32
RARA P10276 1/20 0.31
RARB P10826 1/20 0.31
RARG P13631 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
SCHEMBL1022350 0.91 PTGS2 (0.49) PTGS2PTGS1PDE5AHSD17B1PGR
SCHEMBL1021324 0.90 PTGS2 (0.48) PTGS2PTGS1PDE5AHSD17B1PGR
SCHEMBL1025830 0.88 PTGS2 (0.54) PTGS2PTGS1PDE5AHSD17B1PGR
SCHEMBL1019980 0.83 PTGS1 (0.48) PTGS2PTGS1GCGR
SCHEMBL1021420 0.81 PTGS2 (0.50) PTGS2PTGS1PDE5AHSD17B1PGR
SCHEMBL1022426 0.79 HSD17B1 (0.47) PTGS2PTGS1HSD17B1RARARARB
SCHEMBL1022437 0.78 PTGS2 (0.34) PTGS2PTGS1GCGR
SCHEMBL1022436 0.78 PTGS2 (0.34) PTGS2PTGS1GCGR
SCHEMBL1023688 0.78 PTGS2 (0.51) PTGS2PTGS1PGRRARARARB
SCHEMBL1021898 0.77 MGLL (0.41) PTGS2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1841729-B1 2-CYCLOPENTEN-1-ONE OXIME DERIVATIVES INHIBITING PRODUCTION OF TNF-ALPHA AMOREPACIFIC CORP (KR) 2011-01-12 EP claimed
US-8013187-B2 2-cyclopenten-1-one oxime derivatives inhibiting production of TNF-α AMOREPACIFIC CORPORATION (KR) 2011-09-06 US disclosed
EP-1841729-B1 2-CYCLOPENTEN-1-ONE OXIME DERIVATIVES INHIBITING PRODUCTION OF TNF-ALPHA AMOREPACIFIC CORP (KR) 2011-01-12 EP disclosed
US-20090036501-A1 2-Cyclopenten-1-One Oxime Derivatives Inhibiting Production of TNF-Alpha AMOREPACIFIC CORPORATION (KR) 2009-02-05 US disclosed
EP-1841729-A1 2-CYCLOPENTEN-1-ONE OXIME DERIVATIVES INHIBITING PRODUCTION OF TNF-ALPHA Amorepacific Corporation (KR) 2007-10-10 EP disclosed
WO-2006059867-A1 2-CYCLOPENTEN-1-ONE OXIME DERIVATIVES INHIBITING PRODUCTION OF TNF-ALPHA AMOREPACIFIC CORPORATION (KR) 2006-06-08 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-20090036501-A1 2-Cyclopenten-1-One Oxime Derivatives Inhibiting Production of TNF-Alpha TNF, PDE4A, PDE3B PTGS2 27/4885PTGS1 15/4885PDE5A 7/4885

“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.