SCHEMBL28211137

SCHEMBL28211137

CCCCCCC(CC)C(=O)P(=O)(O)O

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FDPS P14324 5/20 0.53
CA2 P00918 4/20 0.50
LAP3 P28838 2/20 0.50
MAPK1 P28482 1/20 0.50
SMPD1 P17405 3/20 0.48
CA1 P00915 1/20 0.48
S1PR2 O95136 4/20 0.46
S1PR1 P21453 4/20 0.46
S1PR3 Q99500 4/20 0.46
S1PR4 O95977 3/20 0.46

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
SCHEMBL16987203 0.94 FDPS (0.55) FDPSCA2LAP3SMPD1S1PR2
SCHEMBL16987214 0.94 FDPS (0.55) FDPSCA2LAP3SMPD1S1PR2
SCHEMBL16987200 0.92 FDPS (0.54) FDPSCA2LAP3SMPD1S1PR2
SCHEMBL4611252 0.92 CA2 (0.59) FDPSCA2LAP3MAPK1CA1
SCHEMBL5301771 0.82 FDPS (0.52) FDPSCA2LAP3MAPK1SMPD1
SCHEMBL8932140 0.79 CA2 (0.58) CA2MAPK1CA1
SCHEMBL2937529 0.79 CA2 (0.58) CA2MAPK1CA1
SCHEMBL7654397 0.79 CA2 (0.58) CA2MAPK1CA1
SCHEMBL7650538 0.79 CA2 (0.58) CA2MAPK1CA1
SCHEMBL27688216 0.79 CA2 (0.58) CA2MAPK1CA1

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-107828207-A Fire retardant combination of stabilizers for thermoplastic polymer 科莱恩塑料和涂料有限公司 2018-03-23 CN claimed