SCHEMBL4220048

SCHEMBL4220048

COc1ccc(CC(=O)Nc2ccc(-c3ccc(C(=O)[C@@H]4CCC[C@H]4C(=O)O)cc3)cc2)cc1OC

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.56
DGAT1 O75907 10/20 0.54
KDM4E B2RXH2 3/20 0.54
MAPT P10636 3/20 0.54
NPSR1 Q6W5P4 2/20 0.54
ALDH1A1 P00352 2/20 0.54
HPGD P15428 2/20 0.54
POLB P06746 1/20 0.54
HSD17B10 Q99714 1/20 0.54
RXFP1 Q9HBX9 1/20 0.54
LMNA P02545 1/20 0.53
HTT P42858 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
BCHE P06276 2/20 0.53
ACHE P22303 2/20 0.53
KMT2A Q03164 2/20 0.51

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
SCHEMBL4220044 1.00 EPHX2 (0.56) EPHX2DGAT1KDM4EMAPTNPSR1
SCHEMBL4220052 1.00 EPHX2 (0.56) EPHX2DGAT1KDM4EMAPTNPSR1
SCHEMBL13752607 0.81 DGAT1 (0.60) DGAT1LMNA
SCHEMBL4226875 0.81 DGAT1 (0.62) DGAT1LMNA
SCHEMBL4226873 0.81 DGAT1 (0.62) DGAT1LMNA
SCHEMBL4226872 0.81 DGAT1 (0.62) DGAT1LMNA
SCHEMBL13752786 0.78 DGAT1 (0.57) DGAT1SMN1; SMN2
SCHEMBL4225798 0.76 DGAT1 (0.51) DGAT1KMT2A
SCHEMBL4225792 0.76 DGAT1 (0.51) DGAT1KMT2A
SCHEMBL4886805 0.76 DGAT1 (0.79) DGAT1KDM4EMAPTPOLBSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090215780-A1 Preparation and Use of Aryl Alkyl Acid Derivatives for the Treatment of Obesity BAYER PHARMACEUTICALS CORPORATION (US) 2009-08-27 US claimed
EP-1874317-A2 PREPARATION AND USE OF ARYL ALKYL ACID DERIVATIVES FOR THE TREATMENT OF OBESITY Bayer Pharmaceuticals Corporation (US) 2008-01-09 EP claimed
WO-2006113919-A2 ARYL ALKYL ACID DERIVATIVES FOR AND USE THEREOF BAYER PHARMACEUTICALS CORPORATION (US) 2006-10-26 WO 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 (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-20090215780-A1 Preparation and Use of Aryl Alkyl Acid Derivatives for the Treatment of Obesity FABP4, GPR119, LIPC EPHX2 739/4885DGAT1 34/4885KDM4E 817/4885

“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.