SCHEMBL3288798

SCHEMBL3288798

O=C(Nc1cccc(OC2CCNCC2)c1)c1ccccc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F10 P00742 2/20 0.53
APOB P04114 9/20 0.52
MTTP P55157 8/20 0.52
GAA P10253 3/20 0.50
KDM4E B2RXH2 3/20 0.50
KCNH2 Q12809 1/20 0.48
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
RXFP1 Q9HBX9 3/20 0.46
GSK3B P49841 1/20 0.46
DYRK1A Q13627 1/20 0.46

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
SCHEMBL3291006 0.90 KCNH2 (0.49) F10GAAKDM4EKCNH2GSK3B
SCHEMBL5145637 0.90 F10 (0.48) F10APOBMTTPGAAKDM4E
SCHEMBL4074915 0.86 APOB (0.51) APOBMTTPGAAKDM4EALDH1A1
SCHEMBL3288697 0.86 SMO (0.56) F10APOBMTTP
SCHEMBL3292142 0.85 MTTP (0.52) APOBMTTPGAAKDM4EALDH1A1
SCHEMBL13329128 0.83 MTTP (0.50) APOBMTTPGAAKDM4EALDH1A1
SCHEMBL3290189 0.83 SMN1; SMN2 (0.51) APOBMTTPGAAKDM4EALDH1A1
SCHEMBL13329154 0.83 KDM4E (0.53) F10GAAKDM4EKCNH2ALDH1A1
Hydrochloric Acid SCHEMBL3314651 0.82 KDM4E (0.52) F10GAAKDM4EKCNH2ALDH1A1
SCHEMBL3292088 0.81 MTTP (0.48) APOBMTTPGAAKDM4EALDH1A1

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-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

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 F10 4037/4885APOB 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.