SCHEMBL480709

SCHEMBL480709

CCN(CC)C(=O)C1CCCC(=O)C1=O

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSPO P30536 3/20 0.43
LMNA P02545 2/20 0.43
TP53 P04637 1/20 0.43
ALOX15 P16050 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL20292477 0.82 TSPO (0.45) TSPOLMNATP53ALOX15SMN1; SMN2
SCHEMBL10827651 0.80 GLI1 (0.34)
SCHEMBL12296371 0.77 MCL1 (0.45) TSPOLMNATP53ALOX15SMN1; SMN2
SCHEMBL15657471 0.74 MKNK1 (0.32) SMN1; SMN2
SCHEMBL14173702 0.72 ALDH1A1 (0.47) LMNASMN1; SMN2ALDH1A1
SCHEMBL1835404 0.71 MCL1 (0.36)
SCHEMBL415873 0.71 TSPO (0.37) TSPOLMNATP53ALOX15SMN1; SMN2
SCHEMBL416854 0.71 TLR4 (0.55) TSPOLMNATP53ALOX15SMN1; SMN2
SCHEMBL25626839 0.70 BRD4 (0.38) SMN1; SMN2ALDH1A1
SCHEMBL15475264 0.69 THRB (0.38) ALDH1A1

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-2411362-A2 INDOLE DERIVATIVES GE Healthcare UK Limited (GB) 2012-02-01 EP disclosed
WO-2010109007-A2 INDOLE DERIVATIVES GE HEALTHCARE LIMITED (GB) 2010-09-30 WO disclosed