SCHEMBL28090572

SCHEMBL28090572

CCCCN1C=CN(CCCCCC(C)C)C1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 1/20 0.34
LMNA P02545 1/20 0.33
DNM1 Q05193 2/20 0.32
GUSB P08236 2/20 0.32
EBP Q15125 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
OPRM1 P35372 1/20 0.31
GBA2 Q9HCG7 6/20 0.30
GBA1 P04062 3/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL28818927 0.89 LMNA (0.33) LMNA
SCHEMBL5294137 0.86 GUSB (0.41) DNM1GUSBEBPSIGMAR1
SCHEMBL5298382 0.86 GUSB (0.41) DNM1GUSBEBPSIGMAR1
SCHEMBL412475 0.86 GUSB (0.41) DNM1GUSBEBPSIGMAR1
SCHEMBL4063558 0.86 GUSB (0.41) DNM1GUSBEBPSIGMAR1
SCHEMBL407655 0.86 GUSB (0.41) DNM1GUSBEBPSIGMAR1
SCHEMBL413207 0.86 GUSB (0.41) DNM1GUSBEBPSIGMAR1
SCHEMBL413478 0.86 GUSB (0.41) DNM1GUSBEBPSIGMAR1
SCHEMBL5301736 0.86 GUSB (0.41) DNM1GUSBEBPSIGMAR1
SCHEMBL5289873 0.86 GUSB (0.41) DNM1GUSBEBPSIGMAR1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106187900-A Method for preparing carboxylate ionic liquid and application of carboxylate ionic liquid 南方科技大学 2016-12-07 CN disclosed