SCHEMBL4080155

SCHEMBL4080155

Cn1c(C(=O)O)nc(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 13/20 0.65
PTGER1 P34995 1/20 0.48
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 2/20 0.47
TSHR P16473 2/20 0.47
HSD17B10 Q99714 1/20 0.47
GAA P10253 1/20 0.45
FABP4 P15090 2/20 0.44
FABP5 Q01469 1/20 0.44
PDE10A Q9Y233 1/20 0.44
DHODH Q02127 1/20 0.42

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
SCHEMBL7110115 0.87 CNR1 (0.62) CNR1PTGER1KDM4EALDH1A1HPGD
SCHEMBL4082543 0.87 CNR1 (0.64) CNR1KDM4EALDH1A1HPGDGAA
SCHEMBL4085388 0.85 CNR1 (0.67) CNR1
SCHEMBL4084936 0.82 CNR1 (0.64) CNR1ALDH1A1FABP4
SCHEMBL4085430 0.79 CNR1 (1.00) CNR1HPGDPDE10A
SCHEMBL4077619 0.78 CNR1 (0.53) CNR1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL1315685 0.76 CNR1 (1.00) CNR1
SCHEMBL4080438 0.75 CNR1 (1.00) CNR1ALDH1A1GAA
SCHEMBL4078116 0.74 CNR1 (0.79) CNR1ALDH1A1
SCHEMBL4075861 0.74 CNR1 (0.79) CNR1KDM4EALDH1A1HPGDTSHR

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
US-7572785-B2 Substituted imidazoles as cannabinoid receptor modulators MERCK & CO., INC. (US) 2009-08-11 US disclosed
US-7057051-B2 Substituted imidazoles as cannabinoid receptor modulators MERCK & CO., INC. (US) 2006-06-06 US disclosed
US-20060089356-A1 Substituted imidazoles as cannabinoid receptor modulators MERCK SHARP & DOHME CORP. 2006-04-27 US disclosed
US-20050171161-A1 antagonizing Cannabinoid-1 (CB1) receptors and inhibiting the enzyme 11 beta -hydroxy steroid dehydrogenase-1 (11 beta -HSD1); appetite suppresion FONG TUNG M (US) 2005-08-04 US disclosed
EP-1482794-A1 METHOD OF TREATMENT OR PREVENTION OF OBESITY Merck & Co., Inc. (US) 2004-12-08 EP disclosed
WO-2003075660-A1 METHOD OF TREATMENT OR PREVENTION OF OBESITY MERCK & CO., INC. (US) 2003-09-18 WO disclosed
US-20030114495-A1 Substituted imidazoles as cannabinoid receptor modulators MERCK SHARP & DOHME CORP. 2003-06-19 US disclosed
WO-2003007887-A2 SUBSTITUTED IMIDAZOLES AS CANNABINOID RECEPTOR MODULATORS MERCK & CO., INC. (US) 2003-01-30 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 (3 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-20060089356-A1 Substituted imidazoles as cannabinoid receptor modulators CNR1, CNR2, GPR119 CNR1 1/4885PTGER1 164/4885KDM4E 1781/4885
US-20030114495-A1 Substituted imidazoles as cannabinoid receptor modulators CNR1, CNR2, GPR119 CNR1 1/4885PTGER1 164/4885KDM4E 1781/4885
US-20050171161-A1 antagonizing Cannabinoid-1 (CB1) receptors and inhibiting the enzyme 11 beta -hydroxy steroid dehydrogenase-1 (11 beta -HSD1); appetite suppresion CNR1, HSD11B1, HSD17B1 CNR1 1/4885PTGER1 350/4885KDM4E 2544/4885

“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.