SCHEMBL5508499

SCHEMBL5508499

CCCN(CCC)C(CC)CCCO

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
FDPS P14324 1/20 0.34
LMNA P02545 2/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL15013530 0.82 PLA2G1B (0.38) FDPSLMNATSHR
SCHEMBL29286448 0.82 LMNA (0.44) ALDH1A1SMN1; SMN2FDPSLMNAHSD17B10
SCHEMBL116821 0.80 PLA2G1B (0.41) FDPSLMNATSHR
SCHEMBL29286804 0.80 PLA2G1B (0.41) FDPSLMNATSHR
SCHEMBL20217373 0.80 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2FDPSTSHR
SCHEMBL29286849 0.80 PLA2G1B (0.41) FDPSLMNATSHR
SCHEMBL19112826 0.79 FDPS (0.36) FDPS
SCHEMBL8493695 0.78 FDPS (0.30) FDPS
SCHEMBL9950179 0.78 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2LMNAHSD17B10MEN1
SCHEMBL29286834 0.77 PLA2G1B (0.38) FDPSLMNATSHR

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-1856168-A1 SAMPLE LYSIS AND COATING OF REACTION SURFACE Qiagen GmbH (DE) 2007-11-21 EP disclosed
WO-2006084650-A1 SAMPLE LYSIS AND COATING OF REACTION SURFACE QIAGEN GMBH (DE) 2006-08-17 WO disclosed