SCHEMBL28154111

SCHEMBL28154111

CCCCCCCCCCCCCCC(O)(CC)OP(=O)(O)O

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 5/20 0.68
FDPS P14324 10/20 0.53
GGPS1 O95749 7/20 0.53
LPAR3 Q9UBY5 4/20 0.50
LPAR1 Q92633 3/20 0.50
LPAR2 Q9HBW0 2/20 0.50

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
SCHEMBL1623430 0.84 SMPD1 (0.60) SMPD1FDPSGGPS1LPAR3LPAR1
SCHEMBL1287809 0.81 SMPD1 (0.72) SMPD1FDPSGGPS1LPAR3LPAR1
SCHEMBL9750400 0.80 SMPD1 (0.47) SMPD1FDPSGGPS1LPAR3LPAR1
SCHEMBL1260436 0.79 SMPD1 (0.65) SMPD1FDPSGGPS1LPAR3LPAR1
SCHEMBL9444629 0.79 SMPD1 (0.65) SMPD1FDPSGGPS1LPAR3LPAR1
SCHEMBL25167791 0.79 SMPD1 (0.65) SMPD1FDPSGGPS1LPAR3LPAR1
SCHEMBL9224959 0.79 SMPD1 (0.65) SMPD1FDPSGGPS1LPAR3LPAR1
SCHEMBL28615637 0.79 SMPD1 (0.65) SMPD1FDPSGGPS1LPAR3LPAR1
SCHEMBL340324 0.79 SMPD1 (0.70) SMPD1FDPSGGPS1LPAR3LPAR1
SCHEMBL1768907 0.79 SMPD1 (0.70) SMPD1FDPSGGPS1LPAR3LPAR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109761325-A The compound adjusting control agent and method of precipitation by metallic ion conversion and flotation removing in a kind of waste water 郑州大学 2019-05-17 CN disclosed
CN-106904712-A A kind of efficient paint mist coagulating agent and preparation method and application 北京柯林沃德科技有限公司 2017-06-30 CN disclosed