SCHEMBL2314966

SCHEMBL2314966

Cc1cc2nc(Nc3ccc(-c4ccc(C(=O)[C@H]5CCC[C@@H]5C(=O)O)cc4)cc3)sc2cc1C

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 18/20 0.60
CSGALNACT1 Q8TDX6 1/20 0.43
LCK P06239 1/20 0.43

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
SCHEMBL2308048 1.00 DGAT1 (0.60) DGAT1CSGALNACT1LCK
SCHEMBL2308884 1.00 DGAT1 (0.60) DGAT1CSGALNACT1LCK
SCHEMBL1748125 0.89 DGAT1 (0.64) DGAT1CSGALNACT1LCK
SCHEMBL1748124 0.89 DGAT1 (0.64) DGAT1CSGALNACT1LCK
SCHEMBL1748123 0.89 DGAT1 (0.64) DGAT1CSGALNACT1LCK
SCHEMBL6032263 0.89 DGAT1 (0.64) DGAT1CSGALNACT1LCK
Bicarbonate SCHEMBL2314968 0.86 DGAT1 (0.44) DGAT1CSGALNACT1LCK
SCHEMBL12430212 0.85 DGAT1 (0.80) DGAT1CSGALNACT1
SCHEMBL2306708 0.85 DGAT1 (0.64) DGAT1CSGALNACT1
SCHEMBL2308770 0.85 DGAT1 (0.64) DGAT1CSGALNACT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8013166-B2 Preparation and use of aryl alkyl acid derivatives for the treatment of obesity BAYER HEALTHCARE LLC (US) 2011-09-06 US claimed
EP-1633722-B1 PREPARATION AND USE OF ARYL ALKYL ACID DERIVATIVES FOR THE TREATMENT OF OBESITY BAYER HEALTHCARE LLC (US) 2011-08-03 EP claimed
US-20090270468-A1 Preparation and use of aryl alkyl acid derivatives for the treatment of obesity SMITH ROGER 2009-10-29 US claimed
US-20090197795-A1 PREPARATION AND USE OF ARYL ALKYL ACID DERIVATIVES FOR THE TREATMENT OF OBESITY BAYER HEALTHCARE LLC (US) 2009-08-06 US claimed
US-20060194859-A1 Preparation and use of aryl alkyl acid derivatives for the treatment of obesity BAYER PHARMACEUTICALS CORPORATION (US) 2006-08-31 US claimed
US-7091228-B2 Preparation and use of aryl alkyl acid derivatives for the treatment of obesity BAYER PHARMACEUTICALS CORPORATION (US) 2006-08-15 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 (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-20060194859-A1 Preparation and use of aryl alkyl acid derivatives for the treatment of obesity FABP4, GPR119, LIPC DGAT1 34/4885CSGALNACT1 1245/4885LCK 3833/4885
US-20090270468-A1 Preparation and use of aryl alkyl acid derivatives for the treatment of obesity FABP4, GPR119, LIPC DGAT1 34/4885CSGALNACT1 1245/4885LCK 3833/4885
US-20090197795-A1 PREPARATION AND USE OF ARYL ALKYL ACID DERIVATIVES FOR THE TREATMENT OF OBESITY FABP4, GPR119, LIPC DGAT1 34/4885CSGALNACT1 1245/4885LCK 3833/4885

“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.