SCHEMBL7107072

SCHEMBL7107072

CCCCCCCCCCCCCCCCCCC(N)(CO)P(=O)(O)O

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FDPS P14324 13/20 0.63
SMPD1 P17405 5/20 0.63
GGPS1 O95749 7/20 0.57
LPAR1 Q92633 1/20 0.53
LPAR3 Q9UBY5 1/20 0.53

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
SCHEMBL8155284 0.98 FDPS (0.62) FDPSSMPD1GGPS1LPAR1LPAR3
SCHEMBL7551569 0.90 FDPS (0.53) FDPSSMPD1GGPS1LPAR3
SCHEMBL5689723 0.90 FDPS (0.70) FDPSSMPD1GGPS1LPAR1LPAR3
SCHEMBL4094991 0.78 FDPS (1.00) FDPSSMPD1GGPS1LPAR1LPAR3
SCHEMBL11773363 0.78 FDPS (1.00) FDPSSMPD1GGPS1LPAR1LPAR3
SCHEMBL293180 0.78 FDPS (1.00) FDPSSMPD1GGPS1LPAR1LPAR3
SCHEMBL11803650 0.78 FDPS (1.00) FDPSSMPD1GGPS1LPAR1LPAR3
SCHEMBL11793619 0.78 FDPS (1.00) FDPSSMPD1GGPS1LPAR1LPAR3
SCHEMBL4088168 0.78 FDPS (1.00) FDPSSMPD1GGPS1LPAR1LPAR3
SCHEMBL11329196 0.78 FDPS (1.00) FDPSSMPD1GGPS1LPAR1LPAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030083313-A1 Treatment of breast cancer with a liposome mixture comprising an antineoplastic alkylphospholipid and water- or lipid-soluble antiestrogen agents MAX-DELBRUCK-CENTRUM FUR MOLEKULARE MEDIZIN (DE) 2003-05-01 US claimed
EP-1135193-B1 AGENTS PROVIDED FOR TREATING TUMORS, BASED ON LIPOSOMES, AND CONTAINING TAMOXIFEN MAX DELBRUECK CENTRUM (DE) 2002-10-30 EP claimed
EP-1135193-A1 AGENTS PROVIDED FOR TREATING TUMORS, BASED ON LIPOSOMES, AND CONTAINING TAMOXIFEN MAX-DELBRÜCK-CENTRUM FÜR MOLEKULARE MEDIZIN (DE) 2001-09-26 EP claimed
WO-2000033917-A1 AGENTS PROVIDED FOR TREATING TUMORS, BASED ON LIPOSOMES, AND CONTAINING TAMOXIFEN Max-Delbrück-Centrum für Molekulare Medizin (DE) 2000-06-15 WO claimed
US-20030083313-A1 Treatment of breast cancer with a liposome mixture comprising an antineoplastic alkylphospholipid and water- or lipid-soluble antiestrogen agents MAX-DELBRUCK-CENTRUM FUR MOLEKULARE MEDIZIN (DE) 2003-05-01 US disclosed
EP-1135193-B1 AGENTS PROVIDED FOR TREATING TUMORS, BASED ON LIPOSOMES, AND CONTAINING TAMOXIFEN MAX DELBRUECK CENTRUM (DE) 2002-10-30 EP disclosed