SCHEMBL4226578

SCHEMBL4226578

CCOC(=O)C(CC(=O)c1ccc(-c2ccc(N)cc2)cc1)Cc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.60
KMT2A Q03164 2/20 0.60
MEN1 O00255 1/20 0.60
EPHX2 P34913 3/20 0.50
PPARG P37231 2/20 0.50
RAB9A P51151 2/20 0.45
LMNA P02545 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
MAOA P21397 1/20 0.44
KMO O15229 1/20 0.43
PPARA Q07869 1/20 0.43
MMP8 P22894 1/20 0.43
MAPT P10636 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MME P08473 1/20 0.41

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
SCHEMBL5068844 1.00 NPC1 (0.60) NPC1KMT2AMEN1EPHX2PPARG
SCHEMBL1748086 0.88 NPC1 (0.58) NPC1KMT2AMEN1EPHX2PPARG
SCHEMBL6031378 0.88 NPC1 (0.58) NPC1KMT2AMEN1EPHX2PPARG
SCHEMBL4235715 0.84 NPC1 (0.55) NPC1KMT2AMEN1EPHX2PPARG
SCHEMBL5067922 0.84 NPC1 (0.55) NPC1KMT2AMEN1EPHX2PPARG
SCHEMBL4222917 0.84 KMT2A (0.65) NPC1KMT2AMEN1EPHX2PPARG
SCHEMBL4227535 0.82 KMT2A (0.51) NPC1KMT2AMEN1EPHX2PPARG
SCHEMBL1748271 0.82 NPC1 (0.55) NPC1KMT2AMEN1RAB9ALMNA
SCHEMBL14571476 0.80 KMT2A (0.68) NPC1KMT2AMEN1RAB9ALMNA
SCHEMBL7530142 0.79 KMT2A (0.75) NPC1KMT2AMEN1RAB9ALMNA

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 5 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
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 NPC1 187/4885KMT2A 627/4885MEN1 4348/4885

“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.