SCHEMBL4455670

SCHEMBL4455670

CCCC1(CCC)COC(=O)N1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.33
MGLL Q99685 3/20 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
SCHEMBL4459894 0.88 S1PR1 (0.37) S1PR1
SCHEMBL4446549 0.83 NPSR1 (0.34) MGLL
SCHEMBL4462359 0.78 S1PR1 (0.33) S1PR1
SCHEMBL2394831 0.76 MGLL (0.32) MGLL
SCHEMBL12427227 0.74 MGLL (0.32) MGLL
SCHEMBL3420125 0.74 KDM4E (0.32) MGLL
SCHEMBL15698614 0.74
SCHEMBL19814031 0.69
SCHEMBL4455865 0.68
SCHEMBL13428539 0.68

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-20090184062-A1 METHOD FOR INHIBITING BIOFILM GROWTH PPG INDUSTRIES OHIO, INC. (US) 2009-07-23 US disclosed