SCHEMBL1849409

SCHEMBL1849409

CCC(=O)OCC(NC(=O)O)C(=O)OCC(OC)OC

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.33
KMT2A Q03164 2/20 0.32
POLB P06746 1/20 0.32
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
CAD P27708 1/20 0.30

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
SCHEMBL783557 0.81 NAAA (0.40) MGAMGAASIMGAM2
SCHEMBL1853831 0.78 L3MBTL1 (0.33) L3MBTL1KMT2APOLBMGAMGAA
SCHEMBL6276297 0.71 MGAM (0.46) MGAMGAASIMGAM2
SCHEMBL3623524 0.69 GAA (0.38) MGAMGAASIMGAM2
SCHEMBL12514827 0.69 ALDH1A1 (0.35) GAA
SCHEMBL13628930 0.68 CYP2C9 (0.38) L3MBTL1KMT2APOLB
SCHEMBL18354703 0.68 CYP1A2 (0.60) L3MBTL1GAA
SCHEMBL1849412 0.68
SCHEMBL11720069 0.67 TSHR (0.43) KMT2A
SCHEMBL783993 0.66 ALDH1A1 (0.46) KMT2A

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-20110178001-A1 PHOSPHONATED RIFAMYCINS AND USES THEREOF FOR THE PREVENTION AND TREATMENT OF BONE AND JOINT INFECTIONS TARGANTA THERAPEUTICS CORP. (US) 2011-07-21 US disclosed
EP-2324041-A2 PHOSPHONATED RIFAMYCINS AND USES THEREOF FOR THE PREVENTION AND TREATMENT OF BONE AND JOINT INFECTIONS Targanta Therapeutics Corp. (US) 2011-05-25 EP 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-20110178001-A1 PHOSPHONATED RIFAMYCINS AND USES THEREOF FOR THE PREVENTION AND TREATMENT OF BONE AND JOINT INFECTIONS BPGM, SOST, PSPH L3MBTL1 2345/4885KMT2A 4393/4885POLB 375/4885

“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.