SCHEMBL4167582

SCHEMBL4167582

CCOP(=O)(COc1cccc(C)c1)OCC

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
KMT2A Q03164 4/20 0.46
MEN1 O00255 2/20 0.44
ACHE P22303 1/20 0.43
POLB P06746 3/20 0.43
GAA P10253 2/20 0.42
MAPK1 P28482 2/20 0.42
MAPT P10636 2/20 0.42
HTT P42858 2/20 0.42
LMNA P02545 1/20 0.41
RAB9A P51151 1/20 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
SCHEMBL23733061 0.86 TDP1 (0.46) TDP1L3MBTL1KMT2AMEN1ACHE
SCHEMBL23733048 0.83 MAOB (0.46) KMT2AMAPTLMNARAB9A
SCHEMBL4156214 0.83 CHRNB2 (0.46) MAPK1
SCHEMBL9055584 0.81 CYP2C9 (0.55) L3MBTL1ACHEPOLBMAPK1MAPT
SCHEMBL13659077 0.80 TP53 (0.36) POLBMAPK1HTTLMNARAB9A
SCHEMBL13538700 0.80 KDM4E (0.50) KMT2AMEN1POLBMAPK1MAPT
SCHEMBL6053843 0.80 TSHR (0.44) L3MBTL1KMT2AMEN1POLB
SCHEMBL13534785 0.80 KMT2A (0.54) TDP1KMT2AMEN1ACHEPOLB
SCHEMBL13654080 0.79 KMT2A (0.58) KMT2AMEN1POLBMAPTRAB9A
SCHEMBL4104850 0.79 CCNT1 (0.44) KMT2APOLBHTTLMNARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090247488-A1 ANTI-INFLAMMATORY PHOSPHONATE COMPOUNDS CANNIZZARO CARINA 2009-10-01 US disclosed
US-20090247488-A1 ANTI-INFLAMMATORY PHOSPHONATE COMPOUNDS CANNIZZARO CARINA 2009-10-01 US disclosed
US-20090247488-A1 ANTI-INFLAMMATORY PHOSPHONATE COMPOUNDS CANNIZZARO CARINA 2009-10-01 US disclosed
US-7432261-B2 Anti-inflammatory phosphonate compounds GILEAD SCIENCES, INC. (US) 2008-10-07 US disclosed
US-7432261-B2 Anti-inflammatory phosphonate compounds GILEAD SCIENCES, INC. (US) 2008-10-07 US disclosed
US-7432261-B2 Anti-inflammatory phosphonate compounds GILEAD SCIENCES, INC. (US) 2008-10-07 US disclosed
US-20060199788-A1 Anti-inflammatory phosphonate compounds GILEAD SCIENCES, INC. 2006-09-07 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 (2 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-20090247488-A1 ANTI-INFLAMMATORY PHOSPHONATE COMPOUNDS PHOSPHO1, TNF, PTGES TDP1 3075/4885L3MBTL1 4852/4885KMT2A 4832/4885
US-20060199788-A1 Anti-inflammatory phosphonate compounds PHOSPHO1, TNF, PTGES TDP1 3075/4885L3MBTL1 4852/4885KMT2A 4832/4885

“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.