SCHEMBL33174

SCHEMBL33174

CCCCCOC(=O)CCN1CC1C

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRB P10828 8/20 0.58
THRA P10827 1/20 0.58
NAAA Q02083 1/20 0.49
DGKA P23743 1/20 0.49
HTR2C P28335 1/20 0.47
MAPT P10636 1/20 0.47
RECQL P46063 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
EPHX2 P34913 3/20 0.45
PRSS1 P07477 1/20 0.43
PRSS2 P07478 1/20 0.43
PRSS3 P35030 1/20 0.43
RAD52 P43351 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL28146 0.95 THRB (0.56) THRBTHRANAAADGKAHTR2C
SCHEMBL16597545 0.93 THRB (0.49) THRBTHRANAAADGKAHTR2C
SCHEMBL10079025 0.92 THRB (0.51) THRBTHRANAAADGKAHTR2C
SCHEMBL673561 0.88 THRB (0.48) THRBTHRADGKAMAPTL3MBTL1
SCHEMBL13327007 0.87 THRB (0.45) THRBTHRANAAAHTR2CMAPT
SCHEMBL672310 0.86 THRB (0.44) THRBTHRADGKAMAPT
SCHEMBL31530004 0.84 THRB (0.43) THRBTHRANAAAHTR2CMAPT
SCHEMBL33242 0.83 THRB (0.45) THRBTHRANAAADGKAHTR2C
SCHEMBL15781675 0.83 NAAA (0.51) THRBTHRANAAADGKAHTR2C
SCHEMBL13327014 0.81 THRB (0.42) THRBTHRADGKAMAPT

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
EP-2279230-B1 ACRYLIC PRESSURE-SENSITIVE ADHESIVES WITH AZIRIDINE CROSSLINKING AGENTS 3M INNOVATIVE PROPERTIES CO (US) 2012-01-18 EP disclosed