SCHEMBL10001487

SCHEMBL10001487

CP(=O)(O)C(Cc1cccnc1)P(=O)(O)O

nearest known ligand 0.82

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FDPS P14324 9/20 0.82
BTN3A1 O00481 1/20 0.49
PDE3A Q14432 1/20 0.49
PKM P14618 1/20 0.44
KMT2A Q03164 1/20 0.44
NAPRT Q6XQN6 1/20 0.44
TBXAS1 P24557 2/20 0.43
KDM4E B2RXH2 1/20 0.42
CHRNB2 P17787 2/20 0.41
CHRNA4 P43681 2/20 0.41

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
SCHEMBL2459769 0.90 FDPS (1.00) FDPSBTN3A1PDE3APKMKMT2A
SCHEMBL31061112 0.90 FDPS (1.00) FDPSBTN3A1PDE3APKMKMT2A
SCHEMBL8167459 0.84 FDPS (0.75) FDPSBTN3A1PDE3APKMKMT2A
Hydrochloric Acid SCHEMBL9174019 0.82 FDPS (0.73) FDPSBTN3A1PDE3APKMKMT2A
SCHEMBL8167482 0.81 FDPS (0.71) FDPSBTN3A1PDE3APKMKMT2A
SCHEMBL8170213 0.78 FDPS (0.66) FDPSBTN3A1PDE3APKMKMT2A
SCHEMBL8166214 0.78 FDPS (0.66) FDPSBTN3A1PDE3APKMKMT2A
Phosphonic Acid SCHEMBL8778216 0.77 FDPS (0.65) FDPSBTN3A1PDE3APKMKMT2A
SCHEMBL7863043 0.76 FDPS (0.69) FDPSBTN3A1PDE3APKMKMT2A
Hydrochloric Acid SCHEMBL9169735 0.76 FDPS (0.66) FDPSBTN3A1PDE3ANAPRTTBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120196835-A1 ENZYME INHIBITING COMPOUNDS AND METHODS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-08-02 US disclosed
US-20120193528-A1 QUANTITATIVE DETERMINATION OF RISEDRONATE IN URINE BY SPE-LC-MS-MS SANOFI-AVENTIS U.S. LLC (US) 2012-08-02 US disclosed
US-8168437-B2 Quantitative determination of risedronate in urine by SPE-LC-MS-MS SANOFI-AVENTIS U.S. LLC (US) 2012-05-01 US disclosed
US-20090320572-A1 THE QUANTITATIVE DETERMINATION OF RISEDRONATE IN URINE BY SPE-LC-MS-MS SANOFI-AVENTIS U.S. LLC (US) 2009-12-31 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-20120196835-A1 ENZYME INHIBITING COMPOUNDS AND METHODS COASY, FADS2, FDPS FDPS 3/4885BTN3A1 4124/4885PDE3A 3438/4885

“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.