SCHEMBL1761350

SCHEMBL1761350

O=C(N[C@@H](Cc1ccc(Cl)cc1)C(=O)O)c1ccc(-c2ccc(Nc3nc4ccc(F)cc4s3)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.66
CSGALNACT1 Q8TDX6 1/20 0.66
LRRK2 Q5S007 2/20 0.56
MAPT P10636 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
TLR3 O15455 1/20 0.46
CA2 P00918 2/20 0.46
TRPV1 Q8NER1 2/20 0.45
WNT3A P56704 2/20 0.44
KDR P35968 1/20 0.44
GAA P10253 2/20 0.44
HPGD P15428 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
TNF P01375 1/20 0.44
LMNA P02545 1/20 0.44
NR2F2 P24468 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL1761347 1.00 DGAT1 (0.66) DGAT1CSGALNACT1LRRK2MAPTSMN1; SMN2
SCHEMBL1761723 0.92 DGAT1 (0.69) DGAT1CSGALNACT1LRRK2MAPTSMN1; SMN2
SCHEMBL1762016 0.87 DGAT1 (0.73) DGAT1CSGALNACT1LRRK2MAPTSMN1; SMN2
SCHEMBL1761332 0.86 DGAT1 (0.75) DGAT1CSGALNACT1LRRK2MAPTSMN1; SMN2
SCHEMBL1761603 0.84 PTGES (0.55) DGAT1CSGALNACT1LRRK2MAPTSMN1; SMN2
SCHEMBL1761804 0.84 DGAT1 (0.75) DGAT1CSGALNACT1LRRK2MAPTSMN1; SMN2
SCHEMBL13249239 0.84 DGAT1 (0.70) DGAT1CSGALNACT1LRRK2MAPTSMN1; SMN2
SCHEMBL1761683 0.84 DGAT1 (0.73) DGAT1CSGALNACT1LRRK2MAPTSMN1; SMN2
SCHEMBL1761343 0.84 DGAT1 (0.70) DGAT1CSGALNACT1LRRK2MAPTSMN1; SMN2
SCHEMBL1761674 0.84 DGAT1 (0.75) DGAT1CSGALNACT1LRRK2MAPTSMN1; SMN2

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 DGAT1 486/4885CSGALNACT1 3157/4885LRRK2 1810/4885
US-20110118302-A1 PREPARATION AND USE OF BIPHENYL-4-YL-CARBONYLAMINO ACID DERIVATIVES FOR THE TREATMENT OF OBESITY FABP4, GPR119, PGC DGAT1 486/4885CSGALNACT1 3157/4885LRRK2 1810/4885

“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.