SCHEMBL7206692

SCHEMBL7206692

CCCCC(CCN)CP(=O)(O)O

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 5/20 0.50
▸ GABBR2 O75899 2/20 0.47
▸ GABBR1 Q9UBS5 2/20 0.47
▸ GABRR1 P24046 1/20 0.47
▸ LAP3 P28838 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ S1PR2 O95136 3/20 0.41
▸ S1PR1 P21453 3/20 0.41
▸ S1PR3 Q99500 3/20 0.41
▸ S1PR4 O95977 2/20 0.41

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
SCHEMBL31169460 0.84 FDPS (0.61) FDPSLAP3S1PR2S1PR1S1PR3
SCHEMBL22895133 0.82 FDPS (0.63) FDPSLAP3S1PR2S1PR1S1PR3
SCHEMBL28236747 0.82 FDPS (0.63) FDPSLAP3S1PR2S1PR1S1PR3
SCHEMBL665561 0.82 FDPS (0.56) FDPSLAP3ALDH1A1TDP1
SCHEMBL28235584 0.82 FDPS (0.63) FDPSLAP3S1PR2S1PR1S1PR3
SCHEMBL24462564 0.82 FDPS (0.63) FDPSLAP3S1PR2S1PR1S1PR3
SCHEMBL7202700 0.81 FDPS (0.50) FDPSLAP3ALDH1A1S1PR2S1PR1
SCHEMBL26597335 0.80 FDPS (0.57) FDPSLAP3S1PR2S1PR1S1PR3
SCHEMBL21385015 0.80 FDPS (0.54) FDPSLAP3ALDH1A1TDP1
SCHEMBL2701703 0.80 FDPS (0.54) FDPSLAP3ALDH1A1TDP1

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
WO-2003014244-A1 BINDING AGENT COMPONENT FOR SURFACE COATING AGENTS WITH IMPROVED ADHESIVE PROPERTIES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-02-20 — — WO disclosed
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