SCHEMBL7549495

SCHEMBL7549495

COc1cc(C(c2ccccc2)c2cc(F)ccc2O)c(Oc2c(Br)cc(CC(=O)O)cc2Br)cc1C(C)C

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 2/20 0.53
THRA P10827 17/20 0.53
THRB P10828 17/20 0.53

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
SCHEMBL7554066 0.93 NR3C1 (0.60) NR3C1THRATHRB
SCHEMBL7547871 0.90 NR3C1 (0.54) NR3C1THRATHRB
SCHEMBL7552803 0.90 NR3C1 (0.53) NR3C1THRATHRB
SCHEMBL7549525 0.88 NR3C1 (0.63) NR3C1THRATHRB
SCHEMBL7545423 0.86 NR3C1 (0.58) NR3C1THRATHRB
SCHEMBL7594693 0.85 NR3C1 (0.53) NR3C1THRATHRB
SCHEMBL7547173 0.85 NR3C1 (0.54) NR3C1THRATHRB
SCHEMBL7546002 0.84 NR3C1 (0.53) NR3C1THRATHRB
SCHEMBL7553582 0.84 NR3C1 (0.62) NR3C1THRATHRB
SCHEMBL7548868 0.83 NR3C1 (0.61) NR3C1THRATHRB

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
WO-2002044120-A1 COMPOUNDS ACTIVE AT THE GLUCOCORTICOID RECEPTOR III KARO BIO AB (SE) 2002-06-06 WO claimed
WO-2002044120-A1 COMPOUNDS ACTIVE AT THE GLUCOCORTICOID RECEPTOR III KARO BIO AB (SE) 2002-06-06 WO disclosed