SCHEMBL9067976

SCHEMBL9067976

CCCCC(CCCC)(C(=O)O)P(=O)(O)O

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FDPS P14324 15/20 0.52
GGPS1 O95749 8/20 0.47
SMPD1 P17405 2/20 0.44
LPAR1 Q92633 1/20 0.44
LPAR3 Q9UBY5 1/20 0.44
AGTR1 P30556 1/20 0.38
OPRM1 P35372 1/20 0.38
PDE3A Q14432 1/20 0.38

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
SCHEMBL4267687 0.96 FDPS (0.53) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL9487614 0.94 GGPS1 (0.57) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL14760426 0.94 FDPS (0.55) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL9486308 0.92 GGPS1 (0.59) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL4267775 0.92 GGPS1 (0.59) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL10902877 0.92 FDPS (0.48) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL11299591 0.91 FDPS (0.44) FDPSGGPS1PDE3A
SCHEMBL11688737 0.88 FDPS (0.50) FDPSGGPS1SMPD1
SCHEMBL4095717 0.81 FDPS (0.53) FDPSGGPS1SMPD1LPAR1LPAR3
SCHEMBL8866988 0.81 FDPS (0.40) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0690890-A1 PHOSPHORUS-CONTAINING FLAME RETARDANTS COURTAULDS PLC (GB) 1996-01-10 EP disclosed
WO-1994021724-A1 PHOSPHORUS-CONTAINING FLAME RETARDANTS COURTAULDS PLC (GB) 1994-09-29 WO disclosed
US-4351796-A Method for scale control CIBA-GEIGY CORPORATION (US) 1982-09-28 US disclosed
EP-0008640-B1 METHOD FOR THE REMOVAL OF HYDROGEN SULFIDE FROM GASES OR LIQUID HYDROCARBONS AND GASES OR LIQUID HYDROCARBONS THUS PURIFIED CIBA-GEIGY AG (CH) 1981-09-16 EP disclosed
US-4251492-A REMOVAL OF HYDROGEN SULFIDE FROM GASES OR LIQUID HYDROCARBONS USING A PHOSPHONIC ACID COMPOUND SEQUESTERING AGENT CIBA-GEIGY CORPORATION (US) 1981-02-17 US disclosed