SCHEMBL3289751

SCHEMBL3289751

Cc1cccc(C(=O)Nc2cccc(OC3CCN(C(=O)CC(C)C)CC3)c2)c1-c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.46
MTTP P55157 8/20 0.42
APOB P04114 7/20 0.42
SMO Q99835 6/20 0.42
PRKAA2 P54646 1/20 0.41
LIPE Q05469 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
NTRK1 P04629 3/20 0.40
KCNH2 Q12809 3/20 0.40
NTRK2 Q16620 3/20 0.40
NTRK3 Q16288 2/20 0.40

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
SCHEMBL3292282 0.90 APOB (0.44) MTTPAPOBSMOPRKAA2NPC1
SCHEMBL3291765 0.90 APOB (0.44) MTTPAPOBSMOPRKAA2NPC1
SCHEMBL3292262 0.90 APOB (0.43) MTTPAPOBSMOPRKAA2NPC1
SCHEMBL3288633 0.90 EPHX2 (0.48) MTTPAPOBSMONPC1RAB9A
SCHEMBL3288774 0.90 MTTP (0.44) MTTPAPOBSMOPRKAA2NPC1
SCHEMBL5165353 0.89 SMO (0.42) MTTPAPOBSMOPRKAA2NPC1
SCHEMBL3313137 0.89 NAMPT (0.49) NAMPTSMOPRKAA2LIPENPC1
SCHEMBL3288902 0.89 EPHX1 (0.46) MTTPAPOBSMOPRKAA2NPC1
SCHEMBL3288874 0.89 APOB (0.45) MTTPAPOBSMOPRKAA2NPC1
SCHEMBL3289783 0.89 SMO (0.46) MTTPAPOBSMOPRKAA2NPC1

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-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
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 NAMPT 1446/4885MTTP 202/4885APOB 23/4885

“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.