SCHEMBL2223723

SCHEMBL2223723

COC(=O)NC1CN(Cc2ccccc2)CCC1C

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 2/20 0.52
DRD2 P14416 6/20 0.51
DRD4 P21917 6/20 0.51
DRD3 P35462 4/20 0.51
SCN4A P35499 2/20 0.50
SIGMAR1 Q99720 4/20 0.49
POLB P06746 1/20 0.49
BCHE P06276 2/20 0.48
ACHE P22303 2/20 0.48
MAOB P27338 1/20 0.48

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
SCHEMBL6078322 1.00 MCHR1 (0.52) MCHR1DRD2DRD4DRD3SCN4A
SCHEMBL16477536 1.00 MCHR1 (0.52) MCHR1DRD2DRD4DRD3SCN4A
SCHEMBL6078330 1.00 MCHR1 (0.52) MCHR1DRD2DRD4DRD3SCN4A
SCHEMBL22521797 1.00 MCHR1 (0.52) MCHR1DRD2DRD4DRD3SCN4A
Hydrochloric Acid SCHEMBL1847619 0.99 MCHR1 (0.51) MCHR1DRD2DRD4DRD3SCN4A
SCHEMBL29631582 0.89 MCHR1 (0.46) MCHR1DRD2DRD4DRD3SCN4A
SCHEMBL565485 0.89 KMT2A (0.55) MCHR1DRD2DRD4DRD3SCN4A
SCHEMBL1470555 0.89 KMT2A (0.55) MCHR1DRD2DRD4DRD3SCN4A
SCHEMBL556530 0.89 KMT2A (0.55) MCHR1DRD2DRD4DRD3SCN4A
SCHEMBL15765888 0.89 KMT2A (0.55) MCHR1DRD2DRD4DRD3SCN4A

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 65 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113614069-B Process for preparing (3R, 4R) -1-benzyl-N, 4-dimethylpiperidin-3-amine or a salt thereof and process for preparing tofacitinib using the same 柳韩洋行 2024-05-28 CN claimed
EP-3927689-B1 PROCESSES FOR PREPARING (3R,4R)-1-BENZYL-N,4-DIMETHYLPIPERIDIN-3-AMINE OR A SALT THEREOF AND PROCESSES FOR PREPARING TOFACITINIB USING THE SAME YUHAN CORP (KR) 2024-01-24 EP claimed
US-20220144774-A1 PROCESSES FOR PREPARING (3R,4R)-1-BENZYL-N,4-DIMETHYLPIPERIDIN-3-AMINE OR A SALT THEREOF AND PROCESSES FOR PREPARING TOFACITINIB USING THE SAME YUHAN CORPORATION (KR) 2022-05-12 US claimed
CN-113614069-A Process for preparing (3R,4R) -1-benzyl-N, 4-dimethylpiperidin-3-amine or a salt thereof and process for preparing tofacitinib using the same 柳韩洋行 2021-11-05 CN claimed
CN-104860872-A Bis-(3R,4R)-1-benzyl-N,4-dimethyl piperidin-3-amine L-di-p-toluyl tartrate synthesis method TIANJIN INST PHARM RESEARCH 2015-08-26 CN claimed
US-12227478-B2 Processes for preparing (3R,4R)-1-benzyl-N,4-dimethylpiperidin-3-amine or a salt thereof and processes for preparing tofacitinib using the same YUHAN CORPORATION (KR) 2025-02-18 US disclosed
CN-113614069-B Process for preparing (3R, 4R) -1-benzyl-N, 4-dimethylpiperidin-3-amine or a salt thereof and process for preparing tofacitinib using the same 柳韩洋行 2024-05-28 CN disclosed
EP-3927689-B1 PROCESSES FOR PREPARING (3R,4R)-1-BENZYL-N,4-DIMETHYLPIPERIDIN-3-AMINE OR A SALT THEREOF AND PROCESSES FOR PREPARING TOFACITINIB USING THE SAME YUHAN CORP (KR) 2024-01-24 EP disclosed
US-20220144774-A1 PROCESSES FOR PREPARING (3R,4R)-1-BENZYL-N,4-DIMETHYLPIPERIDIN-3-AMINE OR A SALT THEREOF AND PROCESSES FOR PREPARING TOFACITINIB USING THE SAME YUHAN CORPORATION (KR) 2022-05-12 US disclosed
US-20220144774-A1 PROCESSES FOR PREPARING (3R,4R)-1-BENZYL-N,4-DIMETHYLPIPERIDIN-3-AMINE OR A SALT THEREOF AND PROCESSES FOR PREPARING TOFACITINIB USING THE SAME YUHAN CORPORATION (KR) 2022-05-12 US disclosed
CN-113614069-A Process for preparing (3R,4R) -1-benzyl-N, 4-dimethylpiperidin-3-amine or a salt thereof and process for preparing tofacitinib using the same 柳韩洋行 2021-11-05 CN disclosed
EP-3421455-B1 IMPROVED PROCESS FOR THE PREPARATION OF CHIRAL 3-AMINO-PIPERIDINS, USEFUL INTERMEDIATES FOR THE PREPARATION OF TOFACITINIB FIS FABBRICA ITALIANA SINTETICI SPA (IT) 2019-03-27 EP disclosed
US-20100291026-A1 PIPERIDINE INHIBITORS OF JANUS KINASE 3 AUSPEX PHARMACEUTICALS, INC. (US) 2010-11-18 US disclosed
US-20100291026-A1 PIPERIDINE INHIBITORS OF JANUS KINASE 3 AUSPEX PHARMACEUTICALS, INC. (US) 2010-11-18 US disclosed
US-20100291026-A1 PIPERIDINE INHIBITORS OF JANUS KINASE 3 AUSPEX PHARMACEUTICALS, INC. (US) 2010-11-18 US disclosed
WO-2010123919-A2 PIPERIDINE INHIBITORS OF JANUS KINASE 3 AUSPEX PHARMACEUTICALS, LLC (US) 2010-10-28 WO disclosed
US-7084277-B2 Reacting 1-alkoxycarbonyl-3-oxo piperidine compound with an amine; reducing with reducing agent PFIZER INC. (US) 2006-08-01 US disclosed
EP-1572649-A2 3-AMINO-PIPERIDINE DERIVATIVES AND PROCESSES FOR THEIR PREPARATION Pfizer Products Inc. (US) 2005-09-14 EP disclosed
WO-2004046112-A2 3-AMINO-PIPERIDINE DERIVATIVES AND PROCESSES FOR THEIR PREPARATION PFIZER PRODUCTS INC. (US) 2004-06-03 WO disclosed
US-20040102627-A1 3-Amino-piperadine derivatives and methods of manufacture PFIZER INC. 2004-05-27 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 (4 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-20220144774-A1 PROCESSES FOR PREPARING (3R,4R)-1-BENZYL-N,4-DIMETHYLPIPERIDIN-3-AMINE OR A SALT THEREOF AND PROCESSES FOR PREPARING TOFACITINIB USING THE SAME JAK3, JAK1, JAK2 MCHR1 3287/4885DRD2 2303/4885DRD4 1110/4885
US-12227478-B2 Processes for preparing (3R,4R)-1-benzyl-N,4-dimethylpiperidin-3-amine or a salt thereof and processes for preparing tofacitinib using the same JAK3, JAK1, JAK2 MCHR1 3218/4885DRD2 2087/4885DRD4 993/4885
US-20040102627-A1 3-Amino-piperadine derivatives and methods of manufacture PRMT5, SRM, CYP1B1 MCHR1 1780/4885DRD2 109/4885DRD4 79/4885
US-20100291026-A1 PIPERIDINE INHIBITORS OF JANUS KINASE 3 JAK2, JAK3, PAK3 MCHR1 4302/4885DRD2 3752/4885DRD4 4096/4885

“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.