SCHEMBL13329020

SCHEMBL13329020

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

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ APOB P04114 8/20 0.44
▸ MTTP P55157 8/20 0.44
▸ NTRK1 P04629 1/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ NTRK3 Q16288 1/20 0.43
▸ NTRK2 Q16620 1/20 0.43
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ SMO Q99835 6/20 0.42
▸ EPHX2 P34913 2/20 0.41
▸ P2RX1 P51575 1/20 0.41
▸ PGR P06401 1/20 0.41
▸ GPR183 P32249 1/20 0.41
▸ PRKAA2 P54646 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
SCHEMBL3288902 0.91 EPHX1 (0.46) APOBMTTPNTRK1KCNH2NTRK3
SCHEMBL3289783 0.91 SMO (0.46) APOBMTTPNTRK1KCNH2NTRK3
SCHEMBL3288874 0.91 APOB (0.45) APOBMTTPNTRK1KCNH2NTRK3
SCHEMBL3288509 0.91 NTRK1 (0.50) APOBMTTPNTRK1KCNH2NTRK3
SCHEMBL3290031 0.90 APOB (0.45) APOBMTTPNTRK1KCNH2NTRK3
SCHEMBL3289658 0.90 APOB (0.45) APOBMTTPNTRK1KCNH2NTRK3
SCHEMBL3289470 0.90 APOB (0.54) APOBMTTPNTRK1KCNH2NTRK3
SCHEMBL3289661 0.90 SMO (0.44) APOBMTTPNTRK1KCNH2NTRK3
SCHEMBL3290024 0.90 NTRK1 (0.48) APOBMTTPNTRK1KCNH2NTRK3
SCHEMBL3293472 0.89 NTRK1 (0.51) APOBMTTPNTRK1KCNH2NTRK3

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-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 APOB 23/4885MTTP 202/4885NTRK1 3143/4885

“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.

Send feedback