SCHEMBL4626795

SCHEMBL4626795

COC(=O)COc1ccc(Cl)cc1C(=O)c1cc(Cl)ccc1OCC(=O)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 1/20 0.47
KMT2A Q03164 3/20 0.47
GAA P10253 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PTGDR2 Q9Y5Y4 3/20 0.46
PTGDR Q13258 1/20 0.46
LRRK2 Q5S007 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
MEN1 O00255 2/20 0.45
MAPT P10636 3/20 0.44
LMNA P02545 2/20 0.44
ALDH1A1 P00352 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
TP53 P04637 2/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL4656398 0.86 PTGER1 (0.52) PTGER1PTGDR2PTGDR
SCHEMBL27533944 0.84 SMN1; SMN2 (0.60) GAASMN1; SMN2PTGDR2PTGDRMAPT
SCHEMBL8403470 0.82 MAPT (0.54) KMT2AGAASMN1; SMN2PTGDR2PTGDR
SCHEMBL13342992 0.82 MAPT (0.59) KMT2ASMN1; SMN2L3MBTL1MEN1MAPT
SCHEMBL27374983 0.81 TDP1 (0.61) GAAL3MBTL1MAPTLMNAALDH1A1
SCHEMBL14058725 0.80 TSHR (0.58) GAAPTGDR2PTGDRL3MBTL1MAPT
SCHEMBL4626196 0.78 MAPT (0.55) PTGER1KMT2AL3MBTL1MEN1MAPT
SCHEMBL8402620 0.78 PTGDR2 (0.48) GAASMN1; SMN2PTGDR2PTGDRMAPT
SCHEMBL14419325 0.77 HPGD (0.58) GAASMN1; SMN2PTGDR2L3MBTL1MAPT
SCHEMBL25337618 0.77 PTGDR (0.56) KMT2APTGDR2PTGDRL3MBTL1MEN1

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-20080312322-A1 Organic Compounds NOVARTIS AG (CH) 2008-12-18 US disclosed
EP-1888505-A1 ORGANIC COMPOUNDS Novartis AG (CH) 2008-02-20 EP disclosed
WO-2006125593-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2006-11-30 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-20080312322-A1 Organic Compounds NR3C2, MRGPRX2, HRH2 PTGER1 81/4885KMT2A 1769/4885GAA 3324/4885

“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.