SCHEMBL27754136

SCHEMBL27754136

COc1ccc(F)cc1CC(C)(C)CC(O)(Cc1ccccc1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 17/20 0.53
SMN1; SMN2 Q16637 1/20 0.46
PGR P06401 2/20 0.45
CYP3A4 P08684 1/20 0.43
CYP2C19 P33261 1/20 0.43
NR3C2 P08235 7/20 0.43

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
SCHEMBL27774973 0.94 NR3C1 (0.46) NR3C1PGRNR3C2
SCHEMBL27774928 0.93 NR3C1 (0.47) NR3C1SMN1; SMN2PGRCYP3A4CYP2C19
SCHEMBL27754147 0.92 NR3C1 (0.47) NR3C1SMN1; SMN2PGRNR3C2
SCHEMBL27774865 0.92 NR3C1 (0.44) NR3C1PGRNR3C2
SCHEMBL28782546 0.90 NR3C1 (0.55) NR3C1SMN1; SMN2PGRCYP3A4CYP2C19
SCHEMBL27774899 0.90 NR3C1 (0.50) NR3C1SMN1; SMN2PGRCYP3A4CYP2C19
SCHEMBL27774909 0.89 NR3C1 (0.54) NR3C1SMN1; SMN2PGRNR3C2
SCHEMBL27774913 0.88 NR3C1 (0.55) NR3C1SMN1; SMN2PGRNR3C2
SCHEMBL27754172 0.87 NR3C1 (0.56) NR3C1SMN1; SMN2PGRNR3C2
SCHEMBL3657125 0.84 NR3C1 (0.71) NR3C1PGRNR3C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101553214-B Compositions and methods for treating, controlling, reducing, ameliorating, or preventing allergy BAUSCH & LOMB INCORPROATED 2012-12-26 CN disclosed
CN-101553214-A Compositions and methods for treating, controlling, reducing, ameliorating, or preventing allergy BAUSCH & LOMB (US) 2009-10-07 CN disclosed
CN-101528208-A Compositions and methods for treating or preventing glaucoma or its progression BAUSCH & LOMB (US) 2009-09-09 CN disclosed
CN-101522196-A Treatment of infections and their sequelae with combined isolated glucocorticoid receptor agonists and anti-infective agents BAUSCH & LOMB (US) 2009-09-02 CN disclosed
CN-101522187-A Compositions and methods for treating, reducing, ameliorating, or alleviating posterior-segment ophthalmic diseases BAUSCH & LOMB (US) 2009-09-02 CN disclosed