SCHEMBL11566341

SCHEMBL11566341

CCCCCS(=O)(=O)C(N)CCCC

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.52
TP53 P04637 1/20 0.45
FAAH O00519 2/20 0.41
OPRM1 P35372 1/20 0.39
LAP3 P28838 2/20 0.36
DPP7 Q9UHL4 1/20 0.36
DNM1 Q05193 1/20 0.36
CA1 P00915 1/20 0.35
S1PR2 O95136 1/20 0.35
S1PR1 P21453 1/20 0.35
S1PR3 Q99500 1/20 0.35

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
SCHEMBL9242890 0.83 TP53 (0.42) CA2TP53LAP3DPP7CA1
SCHEMBL16054496 0.81 NOD1 (0.48) CA2
SCHEMBL28500700 0.79 CA2 (0.53) CA2TP53FAAHCA1
SCHEMBL4671968 0.78 TP53 (0.41) CA2TP53OPRM1LAP3DPP7
SCHEMBL7740349 0.78 CA2 (0.57) CA2TP53FAAHOPRM1DNM1
SCHEMBL17495625 0.77 TP53 (0.46) CA2TP53OPRM1LAP3DPP7
Hydrochloric Acid SCHEMBL4863515 0.77 RELA (0.56) CA2DPP7DNM1
Hydrochloric Acid SCHEMBL4866747 0.77 RELA (0.56) CA2DPP7DNM1
SCHEMBL3051208 0.76 CA2 (0.53) CA2TP53FAAHOPRM1CA1
SCHEMBL17138111 0.76 CA2 (0.64) CA2TP53FAAHOPRM1CA1

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
US-4154610-A Photographic method and film unit FUJI PHOTO FILM CO., LTD. (JP) 1979-05-15 US disclosed