SCHEMBL5780249

SCHEMBL5780249

O=c1[nH]cccc1CN1CCC(CCc2cccc3c2OCO3)CC1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 1/20 0.41
▸ CHRM4 P08173 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ MCHR1 Q99705 1/20 0.40
▸ DRD2 P14416 5/20 0.39
▸ HTR2A P28223 5/20 0.39
▸ DRD3 P35462 5/20 0.39
▸ LMNA P02545 1/20 0.39
▸ EED O75530 1/20 0.38

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
SCHEMBL5781500 0.94 CHRM4 (0.40) FAAHCHRM4L3MBTL1MCHR1DRD2
SCHEMBL5781595 0.93 NMT1 (0.41) FAAHCHRM4L3MBTL1MCHR1DRD2
SCHEMBL5778143 0.92 NMT1 (0.40) FAAHCHRM4L3MBTL1MCHR1DRD2
SCHEMBL5782171 0.85 MCHR1 (0.40) FAAHCHRM4L3MBTL1MCHR1DRD2
SCHEMBL5781748 0.85 DRD2 (0.41) FAAHCHRM4L3MBTL1MCHR1DRD2
SCHEMBL5800721 0.85 MCHR1 (0.43) FAAHCHRM4L3MBTL1MCHR1
SCHEMBL5779441 0.85 MCHR1 (0.41) FAAHCHRM4L3MBTL1MCHR1DRD2
SCHEMBL5779367 0.85 DRD2 (0.38) MCHR1DRD2HTR2ADRD3
SCHEMBL6893592 0.83 DRD2 (0.41) FAAHCHRM4DRD2DRD3
SCHEMBL5782670 0.83 CHRM4 (0.40) FAAHCHRM4L3MBTL1MCHR1DRD2

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 FAAH 646/4885CHRM4 887/4885L3MBTL1 4417/4885

“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.

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