SCHEMBL5297780

SCHEMBL5297780

CCCCCCN1C=CN(CCCC)C1CC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.36
PTGS2 P35354 3/20 0.36
MGLL Q99685 2/20 0.36
FAAH O00519 1/20 0.36
TSHR P16473 1/20 0.35
THRB P10828 1/20 0.35
GUSB P08236 2/20 0.34
EBP Q15125 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
TBXAS1 P24557 1/20 0.34
NPC1 O15118 4/20 0.33
RAB9A P51151 4/20 0.33
HTT P42858 3/20 0.33
DNM1 Q05193 3/20 0.33
GALR3 O60755 2/20 0.33
POLB P06746 2/20 0.33
ATM Q13315 2/20 0.33
MAPK1 P28482 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
KDM4E B2RXH2 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
SCHEMBL5305424 1.00 PTGS1 (0.36) PTGS1PTGS2MGLLFAAHTSHR
SCHEMBL5302498 1.00 PTGS1 (0.36) PTGS1PTGS2MGLLFAAHTSHR
SCHEMBL5291724 1.00 PTGS1 (0.36) PTGS1PTGS2MGLLFAAHTSHR
SCHEMBL5284167 1.00 PTGS1 (0.36) PTGS1PTGS2MGLLFAAHTSHR
SCHEMBL5299205 1.00 PTGS1 (0.36) PTGS1PTGS2MGLLFAAHTSHR
SCHEMBL5290665 1.00 PTGS1 (0.36) PTGS1PTGS2MGLLFAAHTSHR
SCHEMBL5290041 1.00 PTGS1 (0.36) PTGS1PTGS2MGLLFAAHTSHR
SCHEMBL5283384 1.00 PTGS1 (0.36) PTGS1PTGS2MGLLFAAHTSHR
SCHEMBL5296331 1.00 PTGS1 (0.36) PTGS1PTGS2MGLLFAAHTSHR
SCHEMBL5286797 1.00 PTGS1 (0.36) PTGS1PTGS2MGLLFAAHTSHR

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