SCHEMBL4072052

SCHEMBL4072052

CC(C)(C)c1cc(/C=C(/C#N)S(=O)(=O)c2ccc(Cl)cc2)cc([N+](=O)[O-])c1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.42
KMT2A Q03164 6/20 0.42
HPGD P15428 5/20 0.42
ALDH1A1 P00352 4/20 0.42
MAPT P10636 4/20 0.42
RECQL P46063 3/20 0.42
EGFR P00533 3/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
HSD17B10 Q99714 4/20 0.41
ALOX15 P16050 3/20 0.41
LMNA P02545 3/20 0.41
CYP3A4 P08684 3/20 0.41
CYP2C9 P11712 3/20 0.41
TSHR P16473 3/20 0.41
BLM P54132 3/20 0.41
GAA P10253 2/20 0.41
RGS12 O14924 2/20 0.41
GMNN O75496 2/20 0.41
TP53 P04637 2/20 0.41
CYP1A2 P05177 2/20 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
SCHEMBL4072050 1.00 MEN1 (0.42) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL4072053 1.00 MEN1 (0.42) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL3243798 0.89 HPGD (0.51) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL3243805 0.89 HPGD (0.51) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL3243803 0.89 HPGD (0.51) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL4073940 0.84 SMN1; SMN2 (0.48) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL4074879 0.84 SMN1; SMN2 (0.48) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL4074884 0.84 SMN1; SMN2 (0.48) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL4070448 0.81 EGFR (0.60) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL4071185 0.81 EGFR (0.60) MEN1KMT2AHPGDALDH1A1MAPT

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 MEN1 4794/4885KMT2A 2506/4885HPGD 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.