SCHEMBL3961286

SCHEMBL3961286

Cc1ccc2c(/N=C/C(O)(CC(C)(C)c3cc(F)cc4c3OCC4)C(F)(F)F)c(C)ccc2n1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 20/20 0.45
NR3C2 P08235 17/20 0.45
PGR P06401 14/20 0.45
AR P10275 1/20 0.34

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
SCHEMBL3961287 1.00 NR3C1 (0.45) NR3C1NR3C2PGRAR
SCHEMBL4802007 1.00 NR3C1 (0.45) NR3C1NR3C2PGRAR
SCHEMBL4796692 0.93 NR3C1 (0.43) NR3C1NR3C2PGRAR
SCHEMBL3957013 0.93 NR3C1 (0.43) NR3C1NR3C2PGRAR
SCHEMBL3957015 0.93 NR3C1 (0.43) NR3C1NR3C2PGRAR
SCHEMBL3956995 0.88 NR3C1 (0.46) NR3C1NR3C2PGRAR
SCHEMBL3956993 0.88 NR3C1 (0.46) NR3C1NR3C2PGRAR
SCHEMBL4796789 0.88 NR3C1 (0.46) NR3C1NR3C2PGRAR
SCHEMBL6073366 0.80 NR3C1 (0.56) NR3C1NR3C2PGR
SCHEMBL5201951 0.80 NR3C1 (0.56) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1844039-B1 5-SUBSTITUTED QUINOLINE AND ISOQUINOLINE DERIVATIVES, A METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AS ANTIPHLOGISTICS BAYER SCHERING PHARMA AG (DE) 2009-07-15 EP disclosed
US-7417056-B2 5-substituted quinoline and isoquinoline derivatives, a process for their production and their use as anti-inflammatory agents SCHERING AG (DE) 2008-08-26 US disclosed
EP-1844039-A1 5-SUBSTITUTED QUINOLINE AND ISOQUINOLINE DERIVATIVES, A METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AS ANTIPHLOGISTICS Bayer Schering Pharma Aktiengesellschaft (DE) 2007-10-17 EP disclosed
US-20060116396-A1 5-Substituted quinoline and isoquinoline derivatives, a process for their production and their use as anti-inflammatory agents BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2006-06-01 US disclosed
WO-2006050998-A1 5-SUBSTITUTED QUINOLINE AND ISOQUINOLINE DERIVATIVES, A METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AS ANTIPHLOGISTICS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2006-05-18 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-20060116396-A1 5-Substituted quinoline and isoquinoline derivatives, a process for their production and their use as anti-inflammatory agents NFKBIA, PTGS2, PTGES2 NR3C1 2604/4885NR3C2 1476/4885PGR 3086/4885

“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.