SCHEMBL7606507

SCHEMBL7606507

CCC(C)NC(c1ccccc1C)c1cc(OC)c(C(C)C)cc1Oc1c(Br)cc(CC(=O)OC)cc1Br

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.47
THRB P10828 15/20 0.36
THRA P10827 14/20 0.36
RORC P51449 1/20 0.35
LMNA P02545 1/20 0.35
LPAR1 Q92633 1/20 0.33

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
SCHEMBL7250066 0.93 NR3C1 (0.56) NR3C1THRBTHRARORC
SCHEMBL7257207 0.85 NR3C1 (0.51) NR3C1THRBTHRARORCLPAR1
SCHEMBL7251532 0.79 NR3C1 (0.62) NR3C1THRBTHRARORCLMNA
SCHEMBL7254262 0.78 NR3C1 (0.56) NR3C1THRBTHRARORCLPAR1
SCHEMBL7251618 0.78 NR3C1 (0.52) NR3C1THRBTHRA
SCHEMBL7050482 0.78 NR3C1 (0.55) NR3C1THRBTHRARORCLMNA
SCHEMBL7254849 0.78 NR3C1 (0.44) NR3C1THRBTHRARORC
SCHEMBL7250323 0.77 NR3C1 (0.61) NR3C1THRBTHRA
SCHEMBL7250689 0.77 NR3C1 (0.61) NR3C1THRBTHRARORC
SCHEMBL7252303 0.77 NR3C1 (0.59) NR3C1THRBTHRA

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-1265839-A1 COMPOUNDS ACTIVE AT THE GLUCOCORTICOID RECEPTOR KARO BIO AB (SE) 2002-12-18 EP disclosed
WO-2001047859-A1 COMPOUNDS ACTIVE AT THE GLUCOCORTICOID RECEPTOR KARO BIO AB (SE) 2001-07-05 WO disclosed