SCHEMBL7506392

SCHEMBL7506392

O=C(OC(CCCc1ccccc1)CCCc1ccccc1)C1CCCCN1S(=O)(=O)Cl

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 18/20 0.73
PIN1 Q13526 2/20 0.59
FKBP4 Q02790 1/20 0.58
FKBP5 Q13451 1/20 0.58

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
SCHEMBL7227496 1.00 FKBP1A (0.73) FKBP1APIN1FKBP4FKBP5
SCHEMBL7227728 0.82 FKBP1A (0.65) FKBP1APIN1FKBP4FKBP5
SCHEMBL7219542 0.82 FKBP1A (0.80) FKBP1A
SCHEMBL7507945 0.82 FKBP1A (0.80) FKBP1A
SCHEMBL6277972 0.80 PIN1 (0.75) FKBP1APIN1FKBP4FKBP5
SCHEMBL7504251 0.79 FKBP1A (0.66) FKBP1APIN1FKBP4FKBP5
SCHEMBL7221865 0.79 FKBP1A (0.66) FKBP1APIN1FKBP4FKBP5
SCHEMBL7228304 0.79 FKBP1A (0.77) FKBP1APIN1
SCHEMBL5966132 0.78 FKBP1A (1.00) FKBP1A
SCHEMBL4124896 0.77 FKBP1A (0.60) 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-1237869-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR STIMULATING NEURONAL GROWTH AND ELONGATION AGOURON PHARMACEUTICALS, INC. (US) 2002-09-11 EP disclosed
WO-2001040185-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR STIMULATING NEURONAL GROWTH AND ELONGATION AGOURON PHARMACEUTICALS, INC. (US) 2001-06-07 WO disclosed