SCHEMBL6129098

SCHEMBL6129098

COc1cc(C(C=O)OC)cc(OC)c1OC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.43
MAPT P10636 4/20 0.42
CYP3A4 P08684 1/20 0.42
CA9 Q16790 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
ERN1 O75460 1/20 0.41
TUBB4A P04350 2/20 0.40
TUBB P07437 2/20 0.40
TUBA3C P0DPH7 2/20 0.40
TUBA1B P68363 2/20 0.40
TUBA4A P68366 2/20 0.40
TUBB4B P68371 2/20 0.40
TUBB3 Q13509 2/20 0.40
TUBB2A Q13885 2/20 0.40
TUBB8 Q3ZCM7 2/20 0.40
TUBA3E Q6PEY2 2/20 0.40
TUBA1A Q71U36 2/20 0.40
TUBA1C Q9BQE3 2/20 0.40
TUBB6 Q9BUF5 2/20 0.40
TUBB2B Q9BVA1 2/20 0.40

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
SCHEMBL6715720 0.82 L3MBTL1 (0.48) ACHEMAPTCYP3A4CA9L3MBTL1
SCHEMBL2783924 0.78 MAPT (0.47) ACHEMAPTCYP3A4CA9L3MBTL1
SCHEMBL11963646 0.78 MAPT (0.47) ACHEMAPTCYP3A4CA9L3MBTL1
SCHEMBL28134390 0.78 ACHE (0.45) ACHEMAPTCYP3A4CA9L3MBTL1
SCHEMBL11963636 0.78 MAPT (0.47) ACHEMAPTCYP3A4CA9L3MBTL1
SCHEMBL5786402 0.77 ACHE (0.43) ACHEMAPTCYP3A4CA9L3MBTL1
SCHEMBL20400672 0.77 ACHE (0.43) ACHEMAPTCYP3A4CA9L3MBTL1
SCHEMBL10810091 0.77 GAA (0.35) ACHEERN1ALDH1A1GAAMEN1
SCHEMBL20177381 0.76 L3MBTL1 (0.47) ACHEMAPTCYP3A4CA9L3MBTL1
SCHEMBL10808988 0.75 GAA (0.43) MAPTERN1ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050065213-A1 Combretastatin a-4 derivatives having antineoplastic activity LAWRENCE NICHOLAS JAMES (GB) 2005-03-24 US disclosed
EP-1444190-A1 COMBRETASTATIN A-4 DERIVATIVES HAVING ANTINEOPLASTIC ACTIVITY Cancer Research Technology Limited (GB) 2004-08-11 EP disclosed
WO-2003040077-A1 COMBRETASTATIN A-4 DERIVATIVES HAVING ANTINEOPLASTIC ACTIVITY CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2003-05-15 WO 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-20050065213-A1 Combretastatin a-4 derivatives having antineoplastic activity AURKA, AURKB, HDAC4 ACHE 2647/4885MAPT 2531/4885CYP3A4 86/4885

“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.