SCHEMBL6601879

SCHEMBL6601879

CC(C)(C)C(=O)C(=O)N1CCC[C@H]1C(=O)OCCC(c1ccccc1)c1ccccc1

nearest known ligand 0.79

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 19/20 0.79

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
SCHEMBL8796618 0.91 FKBP1A (0.96) FKBP1A
SCHEMBL7253232 0.84 FKBP1A (0.88) FKBP1A
SCHEMBL8099641 0.83 FKBP1A (1.00) FKBP1A
SCHEMBL5966142 0.82 FKBP1A (1.00) FKBP1A
SCHEMBL4677091 0.79 FKBP1A (0.82) FKBP1A
SCHEMBL7424656 0.78 FKBP1A (0.80) FKBP1A
SCHEMBL7605473 0.78 FKBP1A (0.55) FKBP1A
SCHEMBL17921877 0.76 FKBP1A (0.77) FKBP1A
SCHEMBL17921909 0.76 FKBP1A (0.77) FKBP1A
SCHEMBL5966132 0.75 FKBP1A (1.00) FKBP1A

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-0992492-B1 Small molecule inhibitors of rotamase enzyme activity GUILFORD PHARM INC (US) 2004-08-25 EP disclosed
WO-1996040633-A1 SMALL MOLECULE INHIBITORS OF ROTAMASE ENZYME ACTIVITY GUILFORD PHARMACEUTICALS INC. (US) 1996-12-19 WO disclosed