SCHEMBL1762003

SCHEMBL1762003

CCC(C)[C@H](NC(=O)c1ccc(-c2ccc(Nc3nc4ncc(C(F)(F)F)cc4s3)cc2)cc1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 9/20 0.53
CSGALNACT1 Q8TDX6 2/20 0.53
CA2 P00918 3/20 0.40
CA1 P00915 2/20 0.40
AGTR2 P50052 2/20 0.38
DHODH Q02127 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.37
MCHR1 Q99705 1/20 0.36
CFTR P13569 1/20 0.36
CTPS1 P17812 1/20 0.36

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
SCHEMBL1762005 1.00 DGAT1 (0.53) DGAT1CSGALNACT1CA2CA1AGTR2
Trifluoroacetic Acid SCHEMBL1761353 0.98 DGAT1 (0.51) DGAT1CSGALNACT1CA2CA1AGTR2
Trifluoroacetic Acid SCHEMBL1761352 0.98 DGAT1 (0.51) DGAT1CSGALNACT1CA2CA1AGTR2
SCHEMBL1761354 0.90 DGAT1 (0.44) DGAT1CSGALNACT1DHODHPTGDR2MCHR1
SCHEMBL1761958 0.90 DGAT1 (0.44) DGAT1CSGALNACT1CA2CA1AGTR2
SCHEMBL1761960 0.90 DGAT1 (0.44) DGAT1CSGALNACT1CA2CA1AGTR2
SCHEMBL1762132 0.89 DGAT1 (0.47) DGAT1CSGALNACT1DHODHPTGDR2MCHR1
Trifluoroacetic Acid SCHEMBL1761478 0.88 DGAT1 (0.42) DGAT1CSGALNACT1CA2CA1AGTR2
Trifluoroacetic Acid SCHEMBL1761480 0.88 DGAT1 (0.42) DGAT1CSGALNACT1CA2CA1AGTR2
SCHEMBL1761454 0.87 DGAT1 (0.67) DGAT1CSGALNACT1CA2CA1MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110118302-A1 PREPARATION AND USE OF BIPHENYL-4-YL-CARBONYLAMINO ACID DERIVATIVES FOR THE TREATMENT OF OBESITY BAYER PHARMACEUTICALS CORPORATION (US) 2011-05-19 US claimed
EP-1805156-B1 PREPARATION AND USE OF BIPHENYL-4-YL-CARBONYLAMINO ACID DERIVATIVES FOR THE TREATMENT OF OBESITY BAYER HEALTHCARE LLC (US) 2010-12-22 EP claimed
US-7759376-B2 Preparation and use of biphenyl-4-yl-carbonylamino acid derivatives for the treatment of obesity BAYER HEALTHCARE LLC (US) 2010-07-20 US claimed
US-20070265298-A1 Preparation and Use of Biphenyl-4-Yl-Carbonylamino Acid Derivatives for the Treatment of Obesity BAYER PHARMACEUTICALS CORPORATION (US) 2007-11-15 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20070265298-A1 Preparation and Use of Biphenyl-4-Yl-Carbonylamino Acid Derivatives for the Treatment of Obesity FABP4, GPR119, PGC DGAT1 486/4885CSGALNACT1 3157/4885CA2 3327/4885
US-20110118302-A1 PREPARATION AND USE OF BIPHENYL-4-YL-CARBONYLAMINO ACID DERIVATIVES FOR THE TREATMENT OF OBESITY FABP4, GPR119, PGC DGAT1 486/4885CSGALNACT1 3157/4885CA2 3327/4885

“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.