SCHEMBL16697100

SCHEMBL16697100

CCCCCCCCC(C(=O)N(CCCCCCCC)CCCCCCCC)P(=O)(O)OCCCC

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 3/20 0.42
LPAR1 Q92633 2/20 0.42
LPAR2 Q9HBW0 2/20 0.42
SMPD1 P17405 3/20 0.40
FDPS P14324 4/20 0.39
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38
MMP3 P08254 1/20 0.38
MMP8 P22894 1/20 0.38
LAP3 P28838 1/20 0.37
GGPS1 O95749 3/20 0.37
CYP3A4 P08684 1/20 0.36
PLA2G2A P14555 1/20 0.36

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
SCHEMBL10928634 0.88 PLA2G4A (0.39) LPAR3LPAR1LPAR2SMPD1FDPS
SCHEMBL16697061 0.87 LPAR3 (0.40) LPAR3LPAR1LPAR2SMPD1FDPS
SCHEMBL16697211 0.84 FDPS (0.52) SMPD1FDPSMMP1MMP2MMP3
SCHEMBL10928628 0.81 FDPS (0.40) SMPD1FDPSMMP1MMP2MMP3
SCHEMBL11799989 0.81 FDPS (0.52) LPAR3LPAR2SMPD1FDPSMMP1
SCHEMBL16697000 0.73 LPAR3 (0.41) LPAR3LPAR1LPAR2SMPD1FDPS
SCHEMBL7804496 0.72 LPAR3 (0.53) LPAR3LPAR1LPAR2SMPD1FDPS
SCHEMBL10908985 0.70 LPAR3 (0.47) LPAR3LPAR1LPAR2FDPSMMP1
SCHEMBL13924966 0.70 SMPD1 (0.46) LPAR3LPAR1LPAR2SMPD1FDPS
SCHEMBL31514043 0.70 LPAR3 (0.46) LPAR3LPAR1LPAR2MMP1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11466341-B2 Extractant for rare earth extraction from aqueous phosphoric acid solutions and method of extraction Commissariat á l'énergie atomique et aux énergies alternatives (FR) 2022-10-11 US claimed
WO-2022117948-A1 METHOD FOR SELECTIVELY RECOVERING RARE EARTH METALS AND URANIUM(VI) FROM AN AQUEOUS SOLUTION OF PHOSPHORIC ACID COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2022-06-09 WO claimed
US-20190218643-A1 NEW EXTRACTANT, USEFUL FOR EXTRACTING RARE EARTHS FROM AN AQUEOUS PHOSPHORIC ACID SOLUTION, AND THE APPLICATIONS THEREOF UNIVERSITE DE MONTPELLIER (FR) 2019-07-18 US claimed
US-20180355457-A1 METHODS FOR EXTRACTING AND RETRIEVING THE URANIUM PRESENT IN AN AQUEOUS SOLUTION INCLUDING PHOSPHORIC ACID Orano Mining (FR) 2018-12-13 US claimed
US-9441285-B2 Bifunctional compounds useful as ligands of uranium (VI), methods of synthesising same and uses thereof AREVA MINES (FR) 2016-09-13 US claimed
US-20150133688-A1 BIFUNCTIONAL COMPOUNDS USEFUL AS LIGANDS OF URANIUM (VI), METHODS OF SYNTHESISING SAME AND USES THEREOF AREVA MINES (FR) 2015-05-14 US claimed
US-11466341-B2 Extractant for rare earth extraction from aqueous phosphoric acid solutions and method of extraction Commissariat á l'énergie atomique et aux énergies alternatives (FR) 2022-10-11 US disclosed
WO-2022117948-A1 METHOD FOR SELECTIVELY RECOVERING RARE EARTH METALS AND URANIUM(VI) FROM AN AQUEOUS SOLUTION OF PHOSPHORIC ACID COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2022-06-09 WO disclosed
US-20190218643-A1 NEW EXTRACTANT, USEFUL FOR EXTRACTING RARE EARTHS FROM AN AQUEOUS PHOSPHORIC ACID SOLUTION, AND THE APPLICATIONS THEREOF UNIVERSITE DE MONTPELLIER (FR) 2019-07-18 US disclosed
US-20180355457-A1 METHODS FOR EXTRACTING AND RETRIEVING THE URANIUM PRESENT IN AN AQUEOUS SOLUTION INCLUDING PHOSPHORIC ACID Orano Mining (FR) 2018-12-13 US disclosed
US-20180187290-A1 METHOD FOR SEPARATING IRON FROM AN ORGANIC PHASE CONTAINING URANIUM AND METHOD FOR EXTRACTING URANIUM FROM AN AQUEOUS SOLUTION OF MINERAL ACID CONTAINING URANIUM AND IRON AREVA MINES (FR) 2018-07-05 US disclosed
US-9441285-B2 Bifunctional compounds useful as ligands of uranium (VI), methods of synthesising same and uses thereof AREVA MINES (FR) 2016-09-13 US disclosed
US-20150133688-A1 BIFUNCTIONAL COMPOUNDS USEFUL AS LIGANDS OF URANIUM (VI), METHODS OF SYNTHESISING SAME AND USES THEREOF AREVA MINES (FR) 2015-05-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150133688-A1 BIFUNCTIONAL COMPOUNDS USEFUL AS LIGANDS OF URANIUM (VI), METHODS OF SYNTHESISING SAME AND USES THEREOF URB2, CHRM2, C1S LPAR3 1152/4885LPAR1 1894/4885LPAR2 1444/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.