SCHEMBL5299590

SCHEMBL5299590

CCCCCCCN1C=CN(CC)C1CCC

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.33
PTGS2 P35354 3/20 0.33
MGLL Q99685 2/20 0.33
FAAH O00519 1/20 0.33
GUSB P08236 2/20 0.32
EBP Q15125 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
TBXAS1 P24557 1/20 0.32
NPC1 O15118 5/20 0.31
RAB9A P51151 5/20 0.31
HTT P42858 4/20 0.31
GALR3 O60755 2/20 0.31
POLB P06746 2/20 0.31
ATM Q13315 2/20 0.31
MAPK1 P28482 2/20 0.31
NPSR1 Q6W5P4 2/20 0.31
LMNA P02545 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
KDM4E B2RXH2 1/20 0.31
HSP90AA1 P07900 1/20 0.31

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
SCHEMBL5293905 1.00 PTGS1 (0.33) PTGS1PTGS2MGLLFAAHGUSB
SCHEMBL5301333 1.00 PTGS1 (0.33) PTGS1PTGS2MGLLFAAHGUSB
SCHEMBL5288398 1.00 PTGS1 (0.33) PTGS1PTGS2MGLLFAAHGUSB
SCHEMBL5811331 1.00 PTGS1 (0.33) PTGS1PTGS2MGLLFAAHGUSB
SCHEMBL5815517 1.00 PTGS1 (0.33) PTGS1PTGS2MGLLFAAHGUSB
SCHEMBL5304752 1.00 PTGS1 (0.33) PTGS1PTGS2MGLLFAAHGUSB
SCHEMBL5818606 1.00 PTGS1 (0.33) PTGS1PTGS2MGLLFAAHGUSB
SCHEMBL5293841 1.00 PTGS1 (0.33) PTGS1PTGS2MGLLFAAHGUSB
SCHEMBL5291784 1.00 PTGS1 (0.33) PTGS1PTGS2MGLLFAAHGUSB
SCHEMBL5297037 1.00 PTGS1 (0.33) PTGS1PTGS2MGLLFAAHGUSB

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
WO-2007006418-A1 IONIC-LIQUID-CONTAINING PRODUCTS FOR DYEING AND/OR BRIGHTENING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-01-18 WO disclosed
WO-2006131234-A1 COSMETIC COMPOSITIONS COMPRISING IONIC LIQUIDS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-12-14 WO disclosed