SCHEMBL4070550

SCHEMBL4070550

COc1cc(C=C(C#N)S(=O)(=O)c2ccc(Cl)cc2)cc(OC)c1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 8/20 0.60
PKM P14618 4/20 0.53
HPGD P15428 3/20 0.53
ERBB2 P04626 3/20 0.47
ALDH1A1 P00352 5/20 0.47
KDM4E B2RXH2 3/20 0.47
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
ALOX15 P16050 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HSD17B10 Q99714 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
GAA P10253 2/20 0.46
ALOX12 P18054 2/20 0.46
POLB P06746 1/20 0.46
ALPG P10696 1/20 0.46
MAPT P10636 5/20 0.46
LMNA P02545 2/20 0.46
RGS12 O14924 1/20 0.46

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
SCHEMBL4070549 1.00 EGFR (0.60) EGFRPKMHPGDERBB2ALDH1A1
SCHEMBL4070546 1.00 EGFR (0.60) EGFRPKMHPGDERBB2ALDH1A1
SCHEMBL4072693 0.92 EGFR (0.54) EGFRPKMHPGDERBB2ALDH1A1
SCHEMBL4072697 0.92 EGFR (0.54) EGFRPKMHPGDERBB2ALDH1A1
SCHEMBL4072698 0.92 EGFR (0.54) EGFRPKMHPGDERBB2ALDH1A1
SCHEMBL4072664 0.84 PKM (0.50) EGFRPKMHPGDERBB2ALDH1A1
SCHEMBL4077040 0.84 PKM (0.50) EGFRPKMHPGDERBB2ALDH1A1
SCHEMBL4072666 0.84 PKM (0.50) EGFRPKMHPGDERBB2ALDH1A1
SCHEMBL13772710 0.81 PTGS2 (0.48) EGFRPKMERBB2ALDH1A1KDM4E
SCHEMBL4073611 0.81 EGFR (0.56) EGFRPKMHPGDALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1625112-B1 NOVEL COMPOUNDS FOR TREATMENT OF OBESITY HIGH POINT PHARMACEUTICALS LLC (US) 2009-07-22 EP claimed
JP-2007503453-A 2007-02-22 JP claimed
US-20060128662-A1 Novel compounds for treatment of obesity NOVO NORDISK A/S (DK) 2006-06-15 US claimed
EP-1625112-A1 NOVEL COMPOUNDS FOR TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2006-02-15 EP claimed
WO-2004101505-A1 NOVEL COMPOUNDS FOR TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2004-11-25 WO claimed
EP-1625112-B1 NOVEL COMPOUNDS FOR TREATMENT OF OBESITY HIGH POINT PHARMACEUTICALS LLC (US) 2009-07-22 EP disclosed
US-20060128662-A1 Novel compounds for treatment of obesity NOVO NORDISK A/S (DK) 2006-06-15 US disclosed
EP-1625112-A1 NOVEL COMPOUNDS FOR TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2006-02-15 EP disclosed
WO-2004101505-A1 NOVEL COMPOUNDS FOR TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2004-11-25 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-20060128662-A1 Novel compounds for treatment of obesity GPR119, FABP4, HSD17B4 EGFR 4687/4885PKM 1478/4885HPGD 692/4885

“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.