SCHEMBL3636812

SCHEMBL3636812

COC(=O)CC1CCN(CCN(c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.50
▸ OPRM1 P35372 9/20 0.49
▸ DRD2 P14416 1/20 0.44
▸ DRD4 P21917 1/20 0.44
▸ PTGIR P43119 1/20 0.43
▸ ACHE P22303 1/20 0.43
▸ CARM1 Q86X55 1/20 0.43
▸ PRMT6 Q96LA8 1/20 0.43

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
SCHEMBL4251847 0.85 OPRM1 (0.51) OPRM1PTGIRACHE
SCHEMBL3635699 0.84 OPRM1 (0.49) OPRM1PTGIRACHE
Hydrochloric Acid SCHEMBL3639509 0.84 OPRM1 (0.50) OPRM1PTGIR
SCHEMBL13930628 0.82 OPRM1 (0.52) OPRM1DRD2DRD4ACHE
SCHEMBL13930608 0.81 EPHX2 (0.56) OPRM1CARM1PRMT6
SCHEMBL13930609 0.81 EPHX2 (0.57) OPRM1
SCHEMBL13930636 0.81 NPSR1 (0.56) —
SCHEMBL3639722 0.80 OPRM1 (0.52) OPRM1DRD2DRD4ACHE
SCHEMBL13930626 0.80 OPRM1 (0.52) OPRM1ACHE
SCHEMBL13930669 0.80 NPC1 (0.57) OPRM1ACHE

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2164491-A1 PIPERIDINE-4-ACETIC ACID DERIVATIVES AND THEIR USE Euroscreen S.A. (BE) 2010-03-24 — — EP disclosed
US-20090048291-A1 Novel Piperidine-4-Acetic Acid Derivatives and Their Use EUROSCREEN S.A. (BE) 2009-02-19 — — US disclosed
US-20090048291-A1 Novel Piperidine-4-Acetic Acid Derivatives and Their Use EUROSCREEN S.A. (BE) 2009-02-19 — — US disclosed
US-20090048291-A1 Novel Piperidine-4-Acetic Acid Derivatives and Their Use EUROSCREEN S.A. (BE) 2009-02-19 — — US disclosed
WO-2009010477-A1 PIPERIDINE-4-ACETIC ACID DERIVATIVES AND THEIR USE EUROSCREEN S.A. (BE) 2009-01-22 — — WO disclosed
WO-2009010479-A2 HETEROCYCLIC METHYLENE PIPERIDINE DERIVATIVES AND THEIR USE EUROSCREEN S.A. (BE) 2009-01-22 — — WO disclosed
WO-2009010479-A2 HETEROCYCLIC METHYLENE PIPERIDINE DERIVATIVES AND THEIR USE EUROSCREEN S.A. (BE) 2009-01-22 — — WO 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-20090048291-A1 Novel Piperidine-4-Acetic Acid Derivatives and Their Use ALDH1A1, ABAT, ALDH18A1 LTA4H 553/4885OPRM1 202/4885DRD2 691/4885

“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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