SCHEMBL8207495

SCHEMBL8207495

CCCCCCCCCCCCCCCCSCCC(O)(C[N+](C)(C)C)P(=O)(O)O

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FDPS P14324 12/20 0.45
GGPS1 O95749 7/20 0.45
SMPD1 P17405 3/20 0.40
LPAR1 Q92633 1/20 0.40
LPAR3 Q9UBY5 1/20 0.40
CES2 O00748 1/20 0.38
GMNN O75496 1/20 0.38
TP53 P04637 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
CYP2C9 P11712 1/20 0.38
BLM P54132 1/20 0.38
HSD17B10 Q99714 1/20 0.38
FAAH O00519 1/20 0.37
CES1 P23141 1/20 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
SCHEMBL2695072 0.84 FDPS (0.58) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL60846 0.84 FDPS (0.58) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL7188409 0.84 FDPS (0.58) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL905578 0.84 FDPS (0.58) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL1044717 0.84 FDPS (0.58) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL632447 0.84 FDPS (0.58) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL418810 0.84 FDPS (0.58) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL62052 0.84 FDPS (0.58) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL2693656 0.84 FDPS (0.58) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL4638947 0.84 FDPS (0.58) FDPSGGPS1SMPD1LPAR1LPAR3

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
US-6030960-A INHIBITING THE PRODUCTION OF HEPATITIS VIRUS-INDUCED ANTIGENS IN A HUMAN SUBJECT BY ADMINISTERING A COMPOUND WAKE FOREST UNIVERSITY (US) 2000-02-29 US disclosed
US-5770584-A ADMINISTERING AN ALKYL LIPID OR ALKYL LIPID DERIVATIVE VIRICIDES WAKE FOREST UNIVERSITY (US) 1998-06-23 US disclosed