SCHEMBL3593640

SCHEMBL3593640

CC[C@](NC(=O)C(C)(C)F)(Oc1ccc2c(cnn2-c2ccc(F)cc2)c1)c1ccc(C)cc1C

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 18/20 0.51
SMO Q99835 2/20 0.47
PGR P06401 3/20 0.46

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
SCHEMBL3593639 1.00 NR3C1 (0.51) NR3C1SMOPGR
SCHEMBL3597037 0.89 NR3C1 (0.51) NR3C1SMOPGR
SCHEMBL3597041 0.89 NR3C1 (0.51) NR3C1SMOPGR
SCHEMBL3587123 0.88 NR3C1 (0.47) NR3C1SMOPGR
SCHEMBL3587124 0.88 NR3C1 (0.47) NR3C1SMOPGR
SCHEMBL3599365 0.84 NR3C1 (0.51) NR3C1SMOPGR
SCHEMBL3599363 0.84 NR3C1 (0.51) NR3C1SMOPGR
SCHEMBL29205228 0.76 NR3C1 (0.60) NR3C1PGR
SCHEMBL834718 0.75 NR3C1 (0.72) NR3C1PGR
SCHEMBL834719 0.75 NR3C1 (0.72) NR3C1PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7728030-B2 Chemical compounds 572 ASTRAZENECA AB (SE) 2010-06-01 US disclosed