SCHEMBL95187

SCHEMBL95187

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

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FDPS P14324 11/20 0.54
LMNA P02545 3/20 0.54
PDE3A Q14432 2/20 0.54
ADRB3 P13945 1/20 0.54
PDE4D Q08499 1/20 0.54
GRM4 Q14833 1/20 0.41
SMPD1 P17405 2/20 0.40
ALDH1A1 P00352 1/20 0.38
GABBR2 O75899 1/20 0.37
CYP1A2 P05177 1/20 0.37
TSHR P16473 1/20 0.37
THPO P40225 1/20 0.37
GABBR1 Q9UBS5 1/20 0.37
BLM P54132 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
SCHEMBL17915728 0.85 FDPS (0.58) FDPSLMNAPDE3AADRB3PDE4D
SCHEMBL15397158 0.77 FDPS (0.58) FDPSLMNAPDE3AADRB3PDE4D
SCHEMBL8331999 0.76 FDPS (0.56) FDPSLMNASMPD1
SCHEMBL10389143 0.76 LMNA (0.41) FDPSLMNAPDE3AADRB3PDE4D
SCHEMBL28403519 0.74 LMNA (0.39) FDPSLMNAPDE3AADRB3PDE4D
SCHEMBL19212082 0.74 GRM4 (0.58) FDPSLMNAGRM4ALDH1A1BLM
SCHEMBL5162874 0.72 FDPS (0.64) FDPSLMNAPDE3AADRB3PDE4D
SCHEMBL11511845 0.72 FDPS (0.52) FDPSLMNAPDE3AADRB3PDE4D
SCHEMBL7572194 0.72 FDPS (0.42) FDPSLMNAPDE3AADRB3PDE4D
Pamidronic Acid SCHEMBL18361 0.70 FDPS (1.00) FDPSLMNAPDE3AADRB3PDE4D

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-20120058112-A1 ANTIBODIES MERCK SHARP & DOHME CORP. 2012-03-08 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-20120058112-A1 ANTIBODIES IGF1R, EGFR, ERBB3 FDPS 4503/4885LMNA 4663/4885PDE3A 4380/4885

“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.