SCHEMBL1761534

SCHEMBL1761534

COc1cc(-c2ccc(Nc3nc4ccc(F)cc4s3)cc2)ccc1C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 9/20 0.46
HCRTR1 O43613 8/20 0.46
DGAT1 O75907 6/20 0.46
CSGALNACT1 Q8TDX6 1/20 0.46
LMNA P02545 2/20 0.44
CLK1 P49759 1/20 0.44
MAPT P10636 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
LCK P06239 1/20 0.43
ITK Q08881 1/20 0.43
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
TNF P01375 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
NR2F2 P24468 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 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
SCHEMBL1761489 0.91 DGAT1 (0.51) HCRTR2HCRTR1DGAT1CSGALNACT1LMNA
SCHEMBL1761571 0.88 DGAT1 (0.47) HCRTR2HCRTR1DGAT1CSGALNACT1LMNA
SCHEMBL1762130 0.86 DGAT1 (0.54) DGAT1CSGALNACT1LMNACLK1MAPT
SCHEMBL1761358 0.82 DGAT1 (0.57) HCRTR2HCRTR1DGAT1CSGALNACT1LMNA
SCHEMBL1761334 0.81 DGAT1 (0.61) HCRTR2HCRTR1DGAT1CSGALNACT1LMNA
SCHEMBL1761597 0.81 MAPT (0.59) HCRTR2HCRTR1DGAT1CSGALNACT1LMNA
SCHEMBL2294264 0.80 NPC1 (0.44) DGAT1CSGALNACT1LMNACLK1MAPT
SCHEMBL2294278 0.80 NPC1 (0.44) DGAT1CSGALNACT1LMNACLK1MAPT
SCHEMBL1761558 0.79 DGAT1 (0.68) HCRTR2HCRTR1DGAT1CSGALNACT1LMNA
SCHEMBL1761446 0.78 DGAT1 (0.53) HCRTR2HCRTR1DGAT1CSGALNACT1LMNA

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-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
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 disclosed
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 disclosed
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 disclosed
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 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 (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 HCRTR2 668/4885HCRTR1 884/4885DGAT1 486/4885
US-20110118302-A1 PREPARATION AND USE OF BIPHENYL-4-YL-CARBONYLAMINO ACID DERIVATIVES FOR THE TREATMENT OF OBESITY FABP4, GPR119, PGC HCRTR2 668/4885HCRTR1 884/4885DGAT1 486/4885

“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.