SCHEMBL4626196

SCHEMBL4626196

COC(=O)CCCOc1ccc(Cl)cc1Cc1cc(Cl)ccc1OCC(=O)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.55
HPGD P15428 1/20 0.51
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C19 P33261 1/20 0.49
PTGER1 P34995 12/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
MASP2 O00187 1/20 0.45
F2 P00734 1/20 0.45
ALDH1A1 P00352 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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 0.92 PTGER1 (0.52) PTGER1MASP2F2
SCHEMBL2946766 0.85 MAPT (0.58) MAPTPTGER1F2TDP1
SCHEMBL2941158 0.83 MEN1 (0.53) MAPTHPGDCYP3A4PTGER1MEN1
SCHEMBL4910758 0.82 PTGER1 (0.49) MAPTPTGER1
SCHEMBL11069880 0.81 PTGER1 (0.54) MAPTHPGDCYP3A4PTGER1MEN1
SCHEMBL2945003 0.80 PTGER1 (0.47) PTGER1MASP2F2
SCHEMBL2944820 0.79 PTGDR2 (0.52) MAPTHPGDPTGER1MEN1KMT2A
SCHEMBL4626795 0.78 PTGER1 (0.47) MAPTPTGER1MEN1KMT2AALDH1A1
SCHEMBL4627361 0.78 PTGDR (0.58) MAPTCYP1A2F2ALDH1A1TDP1
SCHEMBL4627039 0.78 PTGDR2 (0.52) MAPTMEN1KMT2AF2ALDH1A1

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 MAPT 4232/4885HPGD 525/4885CYP1A2 1094/4885

“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.