SCHEMBL809302

SCHEMBL809302

CCC1CCc2ccccc2C1CC(O)(CNc1cccc2cnccc12)C(F)(F)F

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 4/20 0.57
TRPV1 Q8NER1 15/20 0.49
ROCK2 O75116 1/20 0.39
ROCK1 Q13464 1/20 0.39

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
SCHEMBL821997 0.73 NR3C1 (0.56) NR3C1TRPV1
SCHEMBL809096 0.72 NR3C1 (1.00) NR3C1
SCHEMBL809247 0.71 NR3C1 (1.00) NR3C1
SCHEMBL809160 0.69 NR3C1 (0.89) NR3C1TRPV1
SCHEMBL5616663 0.68 NR3C1 (0.51) NR3C1TRPV1
SCHEMBL809173 0.68 NR3C1 (0.89) NR3C1TRPV1
SCHEMBL292584 0.66 NR3C1 (0.59) NR3C1
SCHEMBL31390424 0.66 NR3C1 (0.59) NR3C1
SCHEMBL3759200 0.66 NR3C1 (0.59) NR3C1
SCHEMBL31390401 0.66 NR3C1 (0.59) NR3C1

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-1776119-B9 TETRAHYDRO-NAPHTHALENE DERIVATIVES AS GLUCOCORTICOID RECEPTOR MODULATORS GLAXO GROUP LTD (GB) 2012-06-13 EP disclosed
EP-1776119-B1 TETRAHYDRO-NAPHTHALENE DERIVATIVES AS GLUCOCORTICOID RECEPTOR MODULATORS GLAXO GROUP LTD (GB) 2012-01-18 EP disclosed