SCHEMBL5778797

SCHEMBL5778797

CC(C)(C)OC(=O)N1CCC(COc2ccccc2CCC2CCCCC2)CC1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
PKM P14618 1/20 0.48
GPR119 Q8TDV5 10/20 0.47
CSF1R P07333 1/20 0.46
RIPK1 Q13546 1/20 0.44
TGFBR1 P36897 1/20 0.44
RBP4 P02753 1/20 0.43
FAAH O00519 1/20 0.42

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
SCHEMBL30988946 0.81 KDM4E (0.55) KDM4EPKMGPR119CSF1RTGFBR1
SCHEMBL791854 0.81 KDM4E (0.55) KDM4EPKMGPR119CSF1RTGFBR1
SCHEMBL27523517 0.80 SCN9A (0.51) KDM4ERBP4
SCHEMBL27331912 0.80 SCN9A (0.51) KDM4ERBP4
SCHEMBL27341185 0.80 SCN9A (0.51) KDM4ERBP4
SCHEMBL22265766 0.80 KDM4E (0.54) KDM4EPKMGPR119CSF1R
SCHEMBL22265811 0.80 KDM4E (0.54) KDM4EPKMGPR119CSF1RRBP4
SCHEMBL3103289 0.80 RBP4 (0.64) KDM4EPKMGPR119CSF1RRBP4
SCHEMBL1475349 0.80 KDM4E (0.54) KDM4EPKMGPR119CSF1RRBP4
SCHEMBL13073506 0.80 KDM4E (0.51) KDM4EPKMGPR119CSF1RTGFBR1

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
EP-1254904-B1 NOVEL PIPERIDINE COMPOUNDS AND DRUGS CONTAINING THE SAME EISAI CO LTD (JP) 2006-05-24 EP disclosed
US-6784192-B2 NA+ CHANNEL INHIBITORY ACTION IS USEFUL FOR THERAPY AND PREVENTION FOR EXAMPLE, ARRHYTHMIA, VARIOUS NEURALGIAS AND ANALGESIC EISAI CO., LTD. (JP) 2004-08-31 US disclosed
US-20030220368-A1 Novel piperidine compouds and drugs containing the same EISAI R&D MANAGEMENT CO., LTD. (JP) 2003-11-27 US disclosed
EP-1254904-A1 NOVEL PIPERIDINE COMPOUNDS AND DRUGS CONTAINING THE SAME Eisai Co., Ltd. (JP) 2002-11-06 EP 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-20030220368-A1 Novel piperidine compouds and drugs containing the same TRPV1, CACNA1D, KCND2 KDM4E 2057/4885PKM 3857/4885GPR119 1815/4885

“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.