SCHEMBL2546643

SCHEMBL2546643

CCN(C(=O)C(CC)(CC)CCN)C(CC)(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FDPS P14324 7/20 0.36
PDE3A Q14432 2/20 0.36
LMNA P02545 1/20 0.36
ADRB3 P13945 1/20 0.36
PDE4D Q08499 1/20 0.36
SMPD1 P17405 2/20 0.32

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
SCHEMBL2543775 0.89 FDPS (0.32) FDPS
SCHEMBL11301592 0.73 MMP1 (0.35) FDPS
SCHEMBL11511845 0.68 FDPS (0.52) FDPSPDE3ALMNAADRB3PDE4D
SCHEMBL5659978 0.65 FDPS (0.48) FDPSPDE3ALMNAADRB3PDE4D
SCHEMBL30823939 0.62 CYP4F2 (0.32) FDPSPDE3ALMNAADRB3PDE4D
SCHEMBL9560658 0.62 MEN1 (0.41) FDPSPDE3ALMNAADRB3PDE4D
SCHEMBL28117043 0.60 TDP1 (0.35) FDPSPDE3ALMNAADRB3PDE4D
SCHEMBL11306475 0.60 FDPS (0.32) FDPSPDE3A
SCHEMBL450544 0.60 MEN1 (0.32) FDPSPDE3ALMNAADRB3PDE4D
SCHEMBL10936504 0.59 FDPS (0.34) FDPSLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110263534-A1 PHOSPHONATED RIFAMYCINS AND USES THEREOF FOR THE PREVENTION AND TREATMENT OF BONE AND JOINT INFECTIONS TARGANTA THERAPEUTICS, INC. 2011-10-27 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-20110263534-A1 PHOSPHONATED RIFAMYCINS AND USES THEREOF FOR THE PREVENTION AND TREATMENT OF BONE AND JOINT INFECTIONS BPGM, SOST, PSPH FDPS 7/4885PDE3A 2874/4885LMNA 3377/4885

“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.