SCHEMBL4264376

SCHEMBL4264376

CCCCCCCCCCCCCCCCCCCCCC[N+](C)(CCO)CCO

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 9/20 0.67
PSMD14 O00487 1/20 0.55
PLA2G1B P04054 1/20 0.55
MMP2 P08253 1/20 0.55
RAD52 P43351 1/20 0.55
ATG4B Q9Y4P1 1/20 0.55
HTT P42858 1/20 0.52
LMNA P02545 2/20 0.50
ALDH1A1 P00352 1/20 0.50
HSD17B10 Q99714 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
TSHR P16473 1/20 0.50
SLC22A1 O15245 1/20 0.50

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
SCHEMBL5176938 1.00 DNM1 (0.67) DNM1PSMD14PLA2G1BMMP2RAD52
SCHEMBL9163282 1.00 DNM1 (0.67) DNM1PSMD14PLA2G1BMMP2RAD52
SCHEMBL296799 1.00 DNM1 (0.67) DNM1PSMD14PLA2G1BMMP2RAD52
SCHEMBL1421833 1.00 DNM1 (0.67) DNM1PSMD14PLA2G1BMMP2RAD52
SCHEMBL6558336 1.00 DNM1 (0.67) DNM1PSMD14PLA2G1BMMP2RAD52
SCHEMBL6142305 1.00 DNM1 (0.67) DNM1PSMD14PLA2G1BMMP2RAD52
SCHEMBL7782005 1.00 DNM1 (0.67) DNM1PSMD14PLA2G1BMMP2RAD52
SCHEMBL7773354 1.00 DNM1 (0.67) DNM1PSMD14PLA2G1BMMP2RAD52
SCHEMBL4448050 1.00 DNM1 (0.67) DNM1PSMD14PLA2G1BMMP2RAD52
SCHEMBL6141904 1.00 DNM1 (0.67) DNM1PSMD14PLA2G1BMMP2RAD52

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-1834996-B1 Pigment preparations based on PY 155 CLARIANT FINANCE BVI LTD (VG) 2009-05-27 EP disclosed
EP-1834996-A1 Pigment preparations based on PY 155 Clariant International Ltd. (CH) 2007-09-19 EP disclosed