SCHEMBL27727331

SCHEMBL27727331

CCCCC(Cl)OP(=O)(O)OBr

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FDPS P14324 6/20 0.42
SMPD1 P17405 3/20 0.41
LAP3 P28838 2/20 0.35
S1PR2 O95136 5/20 0.35
S1PR1 P21453 5/20 0.35
S1PR3 Q99500 5/20 0.35
S1PR4 O95977 4/20 0.35
GGPS1 O95749 3/20 0.34

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
SCHEMBL29288454 0.81 FDPS (0.45) FDPSSMPD1LAP3S1PR2S1PR1
SCHEMBL4669704 0.81 SMPD1 (0.55) FDPSSMPD1LAP3S1PR2S1PR1
SCHEMBL27759001 0.79 SMPD1 (0.48) FDPSSMPD1LAP3S1PR2S1PR1
SCHEMBL27748409 0.78 FDPS (0.39) FDPSSMPD1
SCHEMBL28189880 0.78 PLA2G2C (0.40) FDPSSMPD1
SCHEMBL28934741 0.77 FDPS (0.44) FDPSSMPD1LAP3S1PR2S1PR1
SCHEMBL4669700 0.77 CYP3A4 (0.44) FDPSSMPD1S1PR2S1PR1S1PR3
SCHEMBL28145447 0.74 SELP (0.39) FDPS
SCHEMBL28037444 0.74 FDPS (0.36) FDPSSMPD1LAP3S1PR2S1PR1
SCHEMBL28190511 0.71 CYP3A4 (0.35) FDPSSMPD1

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-101343782-A Method for preparing inorganic flame-proof polyethelene alcohol fibre UNIV QINGDAO (CN) 2009-01-14 CN disclosed