SCHEMBL676013

SCHEMBL676013

COc1ccc(F)cc1C(C)(CF)CC(O)(Cc1cc2cc(C(F)(F)F)ncc2[nH]1)C(F)F

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 20/20 0.53
NR3C2 P08235 14/20 0.53
CYP3A4 P08684 2/20 0.53
PGR P06401 10/20 0.50

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
SCHEMBL3755290 0.90 NR3C1 (0.54) NR3C1NR3C2CYP3A4PGR
SCHEMBL3743370 0.89 NR3C1 (0.53) NR3C1NR3C2CYP3A4PGR
SCHEMBL4555711 0.89 NR3C1 (0.54) NR3C1NR3C2CYP3A4PGR
SCHEMBL3710020 0.88 NR3C1 (0.52) NR3C1NR3C2CYP3A4PGR
SCHEMBL4447862 0.86 NR3C1 (0.71) NR3C1NR3C2CYP3A4PGR
SCHEMBL3746290 0.85 NR3C1 (0.52) NR3C1NR3C2CYP3A4PGR
SCHEMBL3688034 0.84 NR3C1 (0.67) NR3C1NR3C2PGR
SCHEMBL291202 0.81 NR3C1 (0.77) NR3C1NR3C2CYP3A4PGR
SCHEMBL4556027 0.80 NR3C1 (0.54) NR3C1NR3C2CYP3A4PGR
SCHEMBL4556423 0.80 NR3C1 (0.52) NR3C1NR3C2PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110281882-A1 Compositions and Methods for Treating, Controlling, Reducing, or Ameliorating Inflammatory Pain 1261229 B.C. LTD. (CA) 2011-11-17 US disclosed
EP-2056799-A2 COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING GLAUCOMA OR PROGRESSION THEREOF Bausch & Lomb Incorporated (US) 2009-05-13 EP disclosed
WO-2008027796-A2 COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING GLAUCOMA OR PROGRESSION THEREOF BAUSCH & LOMB INCORPORATED (US) 2008-03-06 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-20110281882-A1 Compositions and Methods for Treating, Controlling, Reducing, or Ameliorating Inflammatory Pain PTGIR, MC2R, NR3C1 NR3C1 3/4885NR3C2 18/4885CYP3A4 831/4885

“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.