Piperidine

Piperidine

SCHEMBL3261905

C1CCNCC1.CCN(CC)CC

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.53
▸ CXCR4 P61073 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37

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
Azepane SCHEMBL28558375 1.00 ALDH1A1 (0.53) ALDH1A1CXCR4SMN1; SMN2
Pyrrolidine SCHEMBL28552039 0.97 ALDH1A1 (0.47) ALDH1A1CXCR4SMN1; SMN2
Piperidine SCHEMBL28074884 0.92 ALDH1A1 (0.45) ALDH1A1CXCR4SMN1; SMN2
Azetidine SCHEMBL2507460 0.91 CXCR4 (0.35) ALDH1A1CXCR4SMN1; SMN2
Hexadecane SCHEMBL3392442 0.88 ALDH1A1 (0.41) ALDH1A1
Azetidine SCHEMBL17938012 0.88 CXCR4 (0.33) ALDH1A1CXCR4SMN1; SMN2
Aziridine SCHEMBL29082712 0.87 HIF1A (0.36) —
Piperazine SCHEMBL28595975 0.84 HIF1A (0.43) CXCR4SMN1; SMN2
Piperidine SCHEMBL27996688 0.81 — —
Piperidine SCHEMBL22363260 0.81 ALDH1A1 (0.39) ALDH1A1

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
CN-112661703-B Method for extracting and recovering methylpyrimidinyl alcohol by using nitrogen heterocyclic functionalized ionic liquid 湖南海利高新技术产业集团有限公司 2022-07-01 — — CN disclosed
CN-112661703-A Method for extracting and recovering methyl pyrimidineol by using nitrogen heterocyclic functionalized ionic liquid 湖南海利高新技术产业集团有限公司 2021-04-16 — — CN disclosed
US-20100152491-A1 PROCESSES FOR PREPARING (E)-STYRYLBENZYLSULFONE COMPOUNDS AND USES THEREOF FOR TREATING PROLIFERATIVE DISORDERS EPR PHARMACEUTICALS PVT.LTD 2010-06-17 — — US disclosed
US-4146612-A HORMONE INHIBITORS MERCK & CO., INC. (US) 1979-03-27 — — US disclosed
US-3947410-A OPTICAL BRIGHTENERS CIBA-GEIGY CORPORATION (US) 1976-03-30 — — 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-20100152491-A1 PROCESSES FOR PREPARING (E)-STYRYLBENZYLSULFONE COMPOUNDS AND USES THEREOF FOR TREATING PROLIFERATIVE DISORDERS PCNA, CDC25B, CCNB1 ALDH1A1 926/4885CXCR4 2584/4885SMN1; SMN2 1400/4885

“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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