SCHEMBL5059477

SCHEMBL5059477

C/C=C(\C)C(O)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 4/20 0.40
FDPS P14324 1/20 0.35
BLM P54132 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
FNTA P49354 4/20 0.33
PGGT1B P53609 2/20 0.33
FNTB P49356 2/20 0.33

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
SCHEMBL5064882 1.00 BTN3A1 (0.40) BTN3A1FDPSBLMTDP1FNTA
SCHEMBL5068306 0.83 SMPD1 (0.32)
SCHEMBL5059478 0.83 SMPD1 (0.32)
SCHEMBL1065866 0.77
SCHEMBL6724326 0.77
SCHEMBL2122915 0.72 BTN3A1 (0.44) BTN3A1FDPSBLMTDP1FNTA
SCHEMBL14993783 0.72 BTN3A1 (0.36) BTN3A1FDPSBLMTDP1
SCHEMBL15911054 0.70 FDPS (0.41) BTN3A1FDPSBLMTDP1FNTA
Propene SCHEMBL15540548 0.69 BTN3A1 (0.37) BTN3A1FDPSBLMTDP1FNTA
SCHEMBL2869107 0.69 TDP1 (0.45) BTN3A1FDPSBLMTDP1FNTA

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
US-20080318227-A1 Intermediates and enzymes of the non-mevalonate isoprenoid pathway BACHER ADELBERT 2008-12-25 US disclosed
US-7297509-B2 Intermediates and enzymes of the non-mevalonate isoprenoid pathway Bacher, Adelbert (DE) 2007-11-20 US disclosed
US-20040176570-A1 Intermediates and enzymes of the non-mevalonate isoprenoid pathway ROHDICH, FELIX (DE) 2004-09-09 US disclosed
EP-1377663-A2 INTERMEDIATES AND ENZYMES OF THE NON-MEVALONATE ISOPRENOID PATHWAY Bacher, Adelbert (DE) 2004-01-07 EP disclosed
WO-2002083720-A2 INTERMEDIATES AND ENZYMES OF THE NON-MEVALONATE ISOPRENOID PATHWAY BACHER ADELBERT (DE) 2002-10-24 WO 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 (2 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-20040176570-A1 Intermediates and enzymes of the non-mevalonate isoprenoid pathway FDPS, DHPS, COASY BTN3A1 3513/4885FDPS 1/4885BLM 4170/4885
US-20080318227-A1 Intermediates and enzymes of the non-mevalonate isoprenoid pathway FDPS, DHPS, COASY BTN3A1 3402/4885FDPS 1/4885BLM 4277/4885

“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.