SCHEMBL4014301

SCHEMBL4014301

O=CCOc1ccc(NC(=O)COc2ccc(Cl)cc2Cl)cc1Cl

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.67
KMT2A Q03164 4/20 0.67
L3MBTL1 Q9Y468 2/20 0.60
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2C19 P33261 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
ACHE P22303 1/20 0.57
MAPT P10636 5/20 0.57
HPGD P15428 4/20 0.57
TP53 P04637 3/20 0.57
RAB9A P51151 3/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
TSHR P16473 2/20 0.57
NPC1 O15118 2/20 0.57
PKM P14618 2/20 0.57
MAPK1 P28482 2/20 0.57
HSD17B10 Q99714 1/20 0.56
MITF O75030 1/20 0.55
XBP1 P17861 1/20 0.55

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
SCHEMBL27374650 0.85 MEN1 (0.84) MEN1KMT2AL3MBTL1CYP1A2CYP3A4
SCHEMBL4015603 0.85 NPC1 (0.49) MEN1KMT2AL3MBTL1NPSR1MAPT
SCHEMBL13811482 0.83 NPC1 (0.53) MEN1KMT2AL3MBTL1CYP1A2CYP2C19
SCHEMBL6142006 0.82 MEN1 (0.67) MEN1KMT2AL3MBTL1CYP1A2CYP3A4
SCHEMBL12218388 0.82 MAPT (0.72) MEN1KMT2AL3MBTL1CYP1A2CYP3A4
SCHEMBL3736949 0.81 TDP1 (0.56) NPSR1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL10016463 0.81 MEN1 (1.00) MEN1KMT2AL3MBTL1CYP1A2CYP3A4
SCHEMBL4014336 0.80 MEN1 (0.61) MEN1KMT2AL3MBTL1CYP1A2CYP3A4
SCHEMBL4293548 0.80 MEN1 (0.74) MEN1KMT2AL3MBTL1CYP1A2CYP3A4
SCHEMBL742018 0.79 MEN1 (0.77) MEN1KMT2AL3MBTL1CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1558567-B1 NOVEL AMIDE COMPOUNDS WITH MCH ANTAGONISTIC EFFECT AND MEDICAMENTS COMPRISING SAID COMPOUNDS BOEHRINGER INGELHEIM PHARMA (DE) 2009-06-24 EP disclosed
US-7351719-B2 Amide compounds having MCH-antagonistic activity and medicaments comprising these compounds BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2008-04-01 US disclosed
US-7351719-B2 Amide compounds having MCH-antagonistic activity and medicaments comprising these compounds BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2008-04-01 US disclosed
US-7351719-B2 Amide compounds having MCH-antagonistic activity and medicaments comprising these compounds BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2008-04-01 US disclosed
EP-1558567-A1 NOVEL AMIDE COMPOUNDS WITH MCH ANTAGONISTIC EFFECT AND MEDICAMENTS COMPRISING SAID COMPOUNDS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-08-03 EP disclosed
US-20040152742-A1 Amide compounds having MCH-antagonistic activity and medicaments comprising these compounds BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-08-05 US disclosed
WO-2004039764-A1 NOVEL AMIDE COMPOUNDS WITH MCH ANTAGONISTIC EFFECT AND MEDICAMENTS COMPRISING SAID COMPOUNDS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-05-13 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-20040152742-A1 Amide compounds having MCH-antagonistic activity and medicaments comprising these compounds MCHR2, MCHR1, NPY1R MEN1 1225/4885KMT2A 571/4885L3MBTL1 1276/4885

“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.