SCHEMBL8211896

SCHEMBL8211896

COC(=O)C(=O)N1CCC[C@H]1COCCCc1cccnc1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 17/20 0.55
MTOR P42345 1/20 0.52
FKBP4 Q02790 1/20 0.52
FKBP5 Q13451 1/20 0.52

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
SCHEMBL8204783 0.85 FKBP1A (0.73) FKBP1AMTORFKBP4FKBP5
SCHEMBL15106676 0.73 MEN1 (0.51) FKBP1A
SCHEMBL15106678 0.73 MEN1 (0.51) FKBP1A
SCHEMBL19367184 0.72 FKBP1A (0.58) FKBP1A
SCHEMBL19367185 0.72 FKBP1A (0.58) FKBP1A
SCHEMBL19348271 0.72 FKBP1A (0.58) FKBP1A
SCHEMBL8188560 0.72 FKBP1A (0.52) FKBP1A
SCHEMBL7767569 0.71 FKBP1A (1.00) FKBP1AMTORFKBP4FKBP5
SCHEMBL6927651 0.71 FKBP1A (0.76) FKBP1AMTORFKBP4FKBP5
SCHEMBL7246003 0.71 FKBP1A (0.41) FKBP1AMTORFKBP4FKBP5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000046193-A2 ETHER DERIVATIVES HAVING NEURONAL ACTIVITY SCHERING AKTIENGESELLSCHAFT (DE) 2000-08-10 WO disclosed