SCHEMBL6167953

SCHEMBL6167953

CC(C)(CC(C)(O)C(F)(F)F)c1ccc(Br)c2c1OCO2

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 5/20 0.35
NR3C2 P08235 4/20 0.32
PGR P06401 3/20 0.32
UTS2R Q9UKP6 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
SCHEMBL4820423 0.86 NR3C1 (0.38) NR3C1NR3C2PGR
SCHEMBL4826616 0.79 ALDH1A1 (0.41) NR3C1NR3C2PGR
SCHEMBL4822589 0.77 AOC3 (0.33)
SCHEMBL4820111 0.75 NR3C1 (0.35) NR3C1NR3C2PGR
SCHEMBL4822532 0.70 NR3C1 (0.61) NR3C1NR3C2PGR
SCHEMBL5202432 0.69 NR3C1 (0.34) NR3C1NR3C2PGR
SCHEMBL3533407 0.66 NR3C1 (0.43) NR3C1NR3C2PGR
SCHEMBL3682425 0.63 NR3C1 (0.38) NR3C1NR3C2PGR
SCHEMBL3531222 0.62 NR3C1 (0.38) NR3C1NR3C2PGR
SCHEMBL14081376 0.62 NR3C1 (0.59) 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
CN-1659144-A Quinoline and isoquinoline derivatives, process for their preparation and their use as inflammation inhibitors SCHERING AG (DE) 2005-08-24 CN disclosed
EP-1492771-A1 QUINOLINE AND ISOQUINOLINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND USE THEREOF AS ANTI-INFLAMMATORY AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 2005-01-05 EP disclosed
WO-2003082827-A1 QUINOLINE AND ISOQUINOLINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND USE THEREOF AS ANTI-INFLAMMATORY AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 2003-10-09 WO disclosed