SCHEMBL2807785

SCHEMBL2807785

CCOP(=O)(OCC)C(Cc1ccc(CC=C(C)C)cc1)P(=O)(OCC)OCC

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 3/20 0.48
POLB P06746 2/20 0.39
GGPS1 O95749 1/20 0.36
EED O75530 1/20 0.35
GAA P10253 3/20 0.35
TRPA1 O75762 1/20 0.34
ALDH1A1 P00352 2/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 1/20 0.34
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 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
SCHEMBL381513 0.86 HMGCR (0.47) HMGCRPOLBGGPS1GAAALDH1A1
SCHEMBL5664710 0.80 HMGCR (0.57) HMGCRPOLBGAA
SCHEMBL2809486 0.80 FDPS (0.42) GGPS1TRPA1
SCHEMBL25922136 0.78 HMGCR (0.56) HMGCRPOLBGAAALDH1A1MAPT
SCHEMBL5003858 0.76 HMGCR (0.51) HMGCRPOLBGAAALDH1A1LMNA
SCHEMBL8589065 0.74 HMGCR (0.49) HMGCR
SCHEMBL8170507 0.73 HMGCR (0.55) HMGCRPOLBGAAALDH1A1LMNA
SCHEMBL5007391 0.72 CA1 (0.54) HMGCRALDH1A1LMNAMAPTKDM4E
SCHEMBL25922437 0.70 HMGCR (0.53) HMGCRPOLBGAAL3MBTL1
SCHEMBL5007372 0.70 HMGCR (0.44) HMGCRPOLBGAAALDH1A1MAPT

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-20100240612-A1 Prenylated Bisphosphonates as Anti-tuberculosis Agents UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2010-09-23 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-20100240612-A1 Prenylated Bisphosphonates as Anti-tuberculosis Agents GGPS1, FDPS, DCTPP1 HMGCR 175/4885POLB 820/4885GGPS1 1/4885

“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.