SCHEMBL5056830

SCHEMBL5056830

COC(=O)c1ccccc1NC(=O)N1CCN(c2cnc3ccccc3n2)CC1.O=C(O)c1ccccc1NC(=O)N1CCN(c2cnc3ccccc3n2)CC1

nearest known ligand 0.86

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 15/20 0.86
FAAH O00519 1/20 0.58
KDM4E B2RXH2 2/20 0.56
ALDH1A1 P00352 1/20 0.56
HPGD P15428 1/20 0.56
ALOX12 P18054 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
HSD17B10 Q99714 1/20 0.56
KMT2A Q03164 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
MAPT P10636 2/20 0.55
MAPK1 P28482 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
SCHEMBL5055304 0.96 HCAR2 (0.78) HCAR2FAAHKDM4EALDH1A1HPGD
SCHEMBL5055256 0.93 HCAR2 (1.00) HCAR2FAAH
SCHEMBL5277092 0.90 HCAR2 (0.70) HCAR2FAAHKDM4EALDH1A1HPGD
SCHEMBL13666109 0.89 HCAR2 (1.00) HCAR2FAAH
SCHEMBL13666064 0.86 HCAR2 (0.78) HCAR2FAAHKMT2AL3MBTL1MAPT
SCHEMBL13666121 0.86 HCAR2 (0.66) HCAR2FAAHKDM4EALDH1A1HPGD
SCHEMBL12671399 0.84 HCAR2 (1.00) HCAR2FAAH
SCHEMBL13666072 0.84 HCAR2 (1.00) HCAR2FAAH
SCHEMBL13666082 0.84 HCAR2 (1.00) HCAR2FAAHKDM4EALDH1A1HSD17B10
SCHEMBL13666138 0.84 HCAR2 (0.86) HCAR2FAAHKDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080139565-A1 Anthranilic Acid Derivatives and Their Use in Treatment of Diseases of Lipid Metabolism, in Particular Dyslipidaemia SMITHKLINE BEECHAM CORPORATION 2008-06-12 US disclosed
EP-1848707-A1 AWTHRANILIC ACID DERIVATIVES AND THEIR USE IN TREATMENT OF DISEASES OF LIPID METABOLISM, IN PARTICULAR DYSLIPIDAEMIA SMITHKLINE BEECHAM CORPORATION (US) 2007-10-31 EP disclosed
WO-2006085108-A1 AWTHRANILIC ACID DERIVATIVES AND THEIR USE IN TREATMENT OF DISEASES OF LIPID METABOLISM, IN PARTICULAR DYSLIPIDAEMIA SMITHKLINE BEECHAM CORPORATION (US) 2006-08-17 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-20080139565-A1 Anthranilic Acid Derivatives and Their Use in Treatment of Diseases of Lipid Metabolism, in Particular Dyslipidaemia ANTXR2, CYP46A1, HCAR1 HCAR2 16/4885FAAH 361/4885KDM4E 3897/4885

“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.