SCHEMBL4009147

SCHEMBL4009147

CCN(CC)CCOc1ccc(CCNC(=O)/C=C/c2ccc(Cl)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.58
NLRP3 Q96P20 1/20 0.58
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
RECQL P46063 1/20 0.56
LMNA P02545 1/20 0.53
NDUFS8 O00217 1/20 0.53
COXFA4 O00483 1/20 0.53
NDUFAB1 O14561 1/20 0.53
NDUFA1 O15239 1/20 0.53
NDUFS4 O43181 1/20 0.53
NDUFB5 O43674 1/20 0.53
NDUFB3 O43676 1/20 0.53
NDUFC1 O43677 1/20 0.53
NDUFA2 O43678 1/20 0.53
NDUFS5 O43920 1/20 0.53
NDUFS7 O75251 1/20 0.53
NDUFS2 O75306 1/20 0.53
NDUFS6 O75380 1/20 0.53
NDUFB1 O75438 1/20 0.53

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
SCHEMBL4009150 1.00 MAPT (0.58) MAPTNLRP3KMT2AMEN1RECQL
SCHEMBL7372285 0.81 MAPT (0.86) MAPTNLRP3KMT2AMEN1RECQL
SCHEMBL3867760 0.79 MCHR1 (0.62) MAPTKMT2AMEN1CYP1A2ALDH1A1
SCHEMBL19414167 0.79 MAPT (0.62) MAPTKMT2AMEN1RECQLLMNA
SCHEMBL23291261 0.78 CYP1A2 (0.56) MAPTKMT2AMEN1CYP1A2BCHE
SCHEMBL4375129 0.76 MAPT (0.78) MAPTNLRP3RECQLBCHEACHE
SCHEMBL11569149 0.76 PPARA (0.67) MAPTNLRP3KMT2AMEN1RECQL
SCHEMBL11569152 0.76 PPARA (0.67) MAPTNLRP3KMT2AMEN1RECQL
SCHEMBL25311354 0.76 APP (0.65) MAPTLMNANDUFS8COXFA4NDUFAB1
SCHEMBL29472500 0.76 APP (0.65) MAPTLMNANDUFS8COXFA4NDUFAB1

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 8 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 claimed
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 claimed
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 claimed
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
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 MAPT 4346/4885NLRP3 3576/4885KMT2A 571/4885

“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.