SCHEMBL3289178

SCHEMBL3289178

CCNC(=O)N1CCC(Oc2cccc(NC(=O)c3cccc(C)c3-c3ccc(OC(F)(F)F)cc3)c2)CC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.45
APOB P04114 5/20 0.44
MTTP P55157 5/20 0.44
NTRK1 P04629 1/20 0.44
KCNH2 Q12809 1/20 0.44
NTRK3 Q16288 1/20 0.44
NTRK2 Q16620 1/20 0.44
POLB P06746 1/20 0.43
CFD P00746 1/20 0.42
KLK7 P49862 1/20 0.42
SMO Q99835 2/20 0.42
CYP2C9 P11712 1/20 0.41
CYP2J2 P51589 1/20 0.41
PRKAA2 P54646 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 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
SCHEMBL3289955 0.93 EPHX2 (0.43) EPHX2APOBMTTPNTRK1KCNH2
SCHEMBL3289943 0.93 POLB (0.44) EPHX2APOBMTTPNTRK1KCNH2
SCHEMBL4078615 0.92 EPHX2 (0.44) EPHX2APOBMTTPNTRK1KCNH2
SCHEMBL3291993 0.91 EPHX2 (0.42) EPHX2APOBMTTPNTRK1KCNH2
SCHEMBL3289726 0.91 NTRK1 (0.43) EPHX2APOBMTTPNTRK1KCNH2
SCHEMBL3288519 0.91 SMO (0.47) EPHX2APOBMTTPNTRK1KCNH2
SCHEMBL3288509 0.91 NTRK1 (0.50) EPHX2APOBMTTPNTRK1KCNH2
SCHEMBL3289542 0.91 MAPT (0.48) APOBMTTPPOLBSMOPRKAA2
SCHEMBL13329081 0.91 POLB (0.44) EPHX2APOBMTTPNTRK1KCNH2
SCHEMBL3289550 0.90 EPHX2 (0.41) EPHX2APOBMTTPNTRK1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7723358-B2 Aroyl-O-piperidine derivatives for the treatment of diabetes-related problems MERCK PATENT GMBH (DE) 2010-05-25 US claimed
EP-1753721-B1 AROYL-O-PIPERIDINE DERIVATIVES FOR THE TREATMENT OF DIABETES-RELATED PROBLEMS MERCK PATENT GMBH (DE) 2009-08-05 EP claimed
US-20070254919-A1 Aroyl-O-Piperidine Derivatives for the Treatment of Diabetes-Related Problems MERCK PATENT GMBH (DE) 2007-11-01 US claimed
US-7723358-B2 Aroyl-O-piperidine derivatives for the treatment of diabetes-related problems MERCK PATENT GMBH (DE) 2010-05-25 US disclosed
US-7723358-B2 Aroyl-O-piperidine derivatives for the treatment of diabetes-related problems MERCK PATENT GMBH (DE) 2010-05-25 US disclosed
US-7723358-B2 Aroyl-O-piperidine derivatives for the treatment of diabetes-related problems MERCK PATENT GMBH (DE) 2010-05-25 US disclosed
EP-1753721-B1 AROYL-O-PIPERIDINE DERIVATIVES FOR THE TREATMENT OF DIABETES-RELATED PROBLEMS MERCK PATENT GMBH (DE) 2009-08-05 EP disclosed
US-20070254919-A1 Aroyl-O-Piperidine Derivatives for the Treatment of Diabetes-Related Problems MERCK PATENT GMBH (DE) 2007-11-01 US disclosed
US-20070254919-A1 Aroyl-O-Piperidine Derivatives for the Treatment of Diabetes-Related Problems MERCK PATENT GMBH (DE) 2007-11-01 US disclosed
US-20070254919-A1 Aroyl-O-Piperidine Derivatives for the Treatment of Diabetes-Related Problems MERCK PATENT GMBH (DE) 2007-11-01 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 (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-20070254919-A1 Aroyl-O-Piperidine Derivatives for the Treatment of Diabetes-Related Problems GPR119, FABP4, LIPC EPHX2 1594/4885APOB 23/4885MTTP 202/4885

“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.