SCHEMBL4221489

SCHEMBL4221489

COC(=O)C(CCc1ccccc1)CC(=O)c1ccc(-c2cnc(N)nc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.52
DPP4 P27487 1/20 0.42
MMP12 P39900 1/20 0.41
LNPEP Q9UIQ6 4/20 0.41
F10 P00742 3/20 0.41
PRSS1 P07477 2/20 0.41
F2 P00734 1/20 0.41
NPC1 O15118 2/20 0.40
MEN1 O00255 1/20 0.40
GRIN2B Q13224 1/20 0.39
MAP4K4 O95819 1/20 0.39
RAB9A P51151 1/20 0.39
LMNA P02545 1/20 0.39
ERAP2 Q6P179 1/20 0.39
FAAH O00519 1/20 0.38

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
SCHEMBL5068496 0.89 KMT2A (0.57) KMT2ADPP4MMP12LNPEPF10
SCHEMBL1748263 0.89 KMT2A (0.57) KMT2ADPP4MMP12LNPEPF10
SCHEMBL4222934 0.85 KMT2A (0.48) KMT2ADPP4LNPEPF10PRSS1
SCHEMBL13752641 0.85 DPP4 (0.40) KMT2ADPP4MMP12LNPEPF10
SCHEMBL28325731 0.83 KMT2A (0.74) KMT2ADPP4PRSS1NPC1MEN1
SCHEMBL4227356 0.82 KMT2A (0.51) KMT2ADPP4F10PRSS1F2
SCHEMBL28326830 0.81 KMT2A (0.62) KMT2ADPP4NPC1MEN1RAB9A
SCHEMBL6031378 0.79 NPC1 (0.58) KMT2ADPP4MMP12F10PRSS1
SCHEMBL1748086 0.79 NPC1 (0.58) KMT2ADPP4MMP12F10PRSS1
SCHEMBL4221485 0.78 MMP12 (0.41) MMP12F10PRSS1F2NPC1

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-20090215780-A1 Preparation and Use of Aryl Alkyl Acid Derivatives for the Treatment of Obesity BAYER PHARMACEUTICALS CORPORATION (US) 2009-08-27 US disclosed
US-20090215780-A1 Preparation and Use of Aryl Alkyl Acid Derivatives for the Treatment of Obesity BAYER PHARMACEUTICALS CORPORATION (US) 2009-08-27 US disclosed
EP-1874317-A2 PREPARATION AND USE OF ARYL ALKYL ACID DERIVATIVES FOR THE TREATMENT OF OBESITY Bayer Pharmaceuticals Corporation (US) 2008-01-09 EP disclosed
WO-2006113919-A2 ARYL ALKYL ACID DERIVATIVES FOR AND USE THEREOF BAYER PHARMACEUTICALS CORPORATION (US) 2006-10-26 WO 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 (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 KMT2A 627/4885DPP4 264/4885MMP12 1318/4885

“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.