SCHEMBL7202700

SCHEMBL7202700

CCCCC(CCS)CP(=O)(O)O

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 7/20 0.50
▸ LAP3 P28838 2/20 0.41
▸ CYP3A4 P08684 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ LPAR3 Q9UBY5 3/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ LPAR2 Q9HBW0 1/20 0.38
▸ S1PR2 O95136 4/20 0.37
▸ S1PR1 P21453 4/20 0.37
▸ S1PR3 Q99500 4/20 0.37
▸ S1PR4 O95977 3/20 0.37

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) FDPSLAP3LPAR3LPAR2S1PR2
SCHEMBL22895133 0.82 FDPS (0.63) FDPSLAP3LPAR3LPAR2S1PR2
SCHEMBL28235584 0.82 FDPS (0.63) FDPSLAP3LPAR3LPAR2S1PR2
SCHEMBL28236747 0.82 FDPS (0.63) FDPSLAP3LPAR3LPAR2S1PR2
SCHEMBL665561 0.82 FDPS (0.56) FDPSLAP3CYP3A4L3MBTL1LPAR3
SCHEMBL24462564 0.82 FDPS (0.63) FDPSLAP3LPAR3LPAR2S1PR2
SCHEMBL7206692 0.81 FDPS (0.50) FDPSLAP3ALDH1A1S1PR2S1PR1
SCHEMBL26597335 0.80 FDPS (0.57) FDPSLAP3LPAR3LPAR2S1PR2
SCHEMBL20565552 0.80 FDPS (0.54) FDPSLAP3CYP3A4L3MBTL1LPAR3
SCHEMBL865495 0.80 FDPS (0.54) FDPSLAP3CYP3A4L3MBTL1LPAR3

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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