SCHEMBL7533915

SCHEMBL7533915

CCCC(F)C(F)(F)SC(F)(F)C1CCCN1C(=O)C(=O)c1cc(OC)c(OC)c(OC)c1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 18/20 0.47
FKBP4 Q02790 2/20 0.40
FKBP5 Q13451 2/20 0.40
ABCC1 P33527 1/20 0.40
ABCG2 Q9UNQ0 1/20 0.38

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
SCHEMBL7533911 0.73 FKBP1A (0.47) FKBP1AFKBP4FKBP5ABCC1ABCG2
SCHEMBL1233420 0.69 FKBP1A (0.74) FKBP1AFKBP4FKBP5ABCC1
SCHEMBL1233422 0.69 FKBP1A (0.74) FKBP1AFKBP4FKBP5ABCC1
SCHEMBL7533919 0.67 FKBP1A (0.48) FKBP1AFKBP4FKBP5ABCC1ABCG2
SCHEMBL7473829 0.67 FKBP1A (0.48) FKBP1AFKBP4FKBP5ABCC1ABCG2
SCHEMBL7533920 0.67 FKBP1A (0.48) FKBP1AFKBP4FKBP5ABCC1ABCG2
SCHEMBL21471518 0.67 FKBP1A (0.67) FKBP1AFKBP4FKBP5ABCC1
SCHEMBL1233000 0.67 FKBP1A (0.73) FKBP1AFKBP4FKBP5ABCC1
SCHEMBL7155851 0.66 FKBP1A (0.80) FKBP1AFKBP4FKBP5ABCC1
SCHEMBL5966161 0.66 FKBP1A (0.80) FKBP1AFKBP4FKBP5ABCC1

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-1204657-A1 PIPERIDINE AND PYRROLIDINE DERIVATIVES DISPLAYING NEURONAL ACTIVITY SCHERING AKTIENGESELLSCHAFT (DE) 2002-05-15 EP disclosed
WO-2001012622-A1 PIPERIDINE AND PYRROLIDINE DERIVATIVES DISPLAYING NEURONAL ACTIVITY SCHERING AKTIENGESELLSCHAFT (DE) 2001-02-22 WO disclosed