SCHEMBL1726178

SCHEMBL1726178

COc1c(F)ccc2c1[C@H](C)C[C@](O)(C(F)(F)F)[C@H]2Nc1ccc(F)c2[nH]c(=O)ccc12.Nc1ccc(F)c2[nH]c(=O)ccc12

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 7/20 0.47
PGR P06401 3/20 0.47
AR P10275 2/20 0.47

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
SCHEMBL1261884 0.95 NR3C1 (0.49) NR3C1PGRAR
SCHEMBL1261886 0.95 NR3C1 (0.49) NR3C1PGRAR
SCHEMBL1259936 0.85 NR3C1 (0.58) NR3C1PGRAR
SCHEMBL1259935 0.85 NR3C1 (0.58) NR3C1PGRAR
SCHEMBL1261387 0.84 NR3C1 (0.61) NR3C1PGRAR
SCHEMBL1261386 0.84 NR3C1 (0.61) NR3C1PGRAR
SCHEMBL3535520 0.83 NR3C1 (0.62) NR3C1PGRAR
SCHEMBL1260313 0.82 NR3C1 (0.55) NR3C1PGRAR
SCHEMBL1261434 0.82 NR3C1 (0.55) NR3C1PGRAR
SCHEMBL1260502 0.82 NR3C1 (0.55) NR3C1PGRAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1994005-B9 TETRAHYDRONAPHTHALINE DERIVATIVES, METHODS FOR THE PRODUCTION AND USE THEREOF AS ANTI-INFLAMMATORY AGENTS Bayer Pharma AG (DE) 2012-01-11 EP disclosed
EP-1994005-B1 TETRAHYDRONAPHTHALINE DERIVATIVES, METHODS FOR THE PRODUCTION AND USE THEREOF AS ANTI-INFLAMMATORY AGENTS BAYER SCHERING PHARMA AG (DE) 2011-07-20 EP disclosed