Piperidine

Piperidine

SCHEMBL676507

C1CCNCC1.NCCO

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

MPL

The experimentally established mechanism targets of Piperidine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.53
▸ TSHR P16473 1/20 0.47
▸ 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
Monoethanolamine SCHEMBL27274629 0.87 — —
Pyrrolidine SCHEMBL27815357 0.85 ALDH1A1 (0.38) ALDH1A1TSHRCXCR4SMN1; SMN2
Piperidine SCHEMBL28046835 0.84 ALDH1A1 (0.64) ALDH1A1TSHRCXCR4SMN1; SMN2
Piperazine SCHEMBL699478 0.84 ALDH1A1 (0.57) ALDH1A1TSHRCXCR4SMN1; SMN2
Piperidine SCHEMBL4128881 0.84 ALDH1A1 (0.64) ALDH1A1CXCR4SMN1; SMN2
Piperidine SCHEMBL27814943 0.81 ALDH1A1 (0.60) ALDH1A1TSHRCXCR4SMN1; SMN2
Pyrrolidine SCHEMBL2814299 0.81 — —
Pyrrolidine SCHEMBL28301447 0.81 — —
Monoethanolamine SCHEMBL28158530 0.80 — —
Piperidine SCHEMBL28952742 0.79 ALDH1A1 (0.56) ALDH1A1TSHRCXCR4SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150290277-A1 PHARMACEUTICAL COMPOSITION SUN PHARMA ADVANCED RES CO LTD (IN) 2015-10-15 — — US disclosed
US-9095514-B2 Pharmaceutical composition SUN PHARMA ADVANCED RESEARCH COMPANY LTD. (IN) 2015-08-04 — — US disclosed
US-20150072942-A1 BORONIC ESTER AND ACID COMPOUNDS, SYNTHESIS AND USES MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-03-12 — — US disclosed
US-20130310320-A1 BORONIC ESTER AND ACID COMPOUNDS, SYNTHESIS AND USES MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-11-21 — — US disclosed
CN-102292086-B Pharmaceutical composition SUN PHARMA ADVANCED RES CO LTD 2013-05-08 — — CN disclosed
US-8378099-B2 Boronic ester and acid compounds, synthesis and uses MILLENNIUM PHARMACUETICALS, INC. (US) 2013-02-19 — — US disclosed
CN-102292086-A Pharmaceutical composition — 2011-12-21 — — CN disclosed
US-20110306560-A1 BORONIC ESTER AND ACID COMPOUNDS, SYNTHESIS AND USES MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-12-15 — — US disclosed
US-20110275597-A1 PHARMACEUTICAL COMPOSITION SUN PHARMA ADVANCED RESEARCH COMPANY LIMITED (IN) 2011-11-10 — — US disclosed
EP-2379077-A2 PHARMACEUTICAL COMPOSITION Sun Pharma Advanced Research Company Limited (IN) 2011-10-26 — — EP disclosed
US-6465433-B1 SUCH AS N-(2-PYRIDINE)CARBONYL-L-PHENYLALANINE-L-LEUCINE BORONIC ACID; PROTEASOME INHIBITORS; REDUCING RATE OF MUSCLE PROTEIN DEGRADATION MILLENNIUM PHARMACEUTICALS, INC. 2002-10-15 — — US disclosed
US-6297217-B1 TREATMENT OF CANCER WITH PROTEASE INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. 2001-10-02 — — US disclosed
US-6066730-A Boronic ester and acid compounds, synthesis and uses PROSCRIPT, INC. 2000-05-23 — — US disclosed
US-5780454-A Boronic ester and acid compounds PROSCRIPT, INC. (US) 1998-07-14 — — US disclosed
EP-0788360-A4 BORONIC ESTER AND ACID COMPOUNDS, SYNTHESIS AND USES PROSCRIPT INC (US) 1998-05-06 — — EP disclosed
US-5703104-A Cyclic amides and derivatives thereof DURHAM PHARMACEUTICALS LLC (US) 1997-12-30 — — US disclosed
EP-0788360-A1 BORONIC ESTER AND ACID COMPOUNDS, SYNTHESIS AND USES PROSCRIPT, INC. (US) 1997-08-13 — — EP disclosed
US-5559150-A ANTICOAGULANT, ANTITUMOR, ANTIINFLAMMATORY 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 1996-09-24 — — US disclosed
WO-1996013266-A1 BORONIC ESTER AND ACID COMPOUNDS, SYNTHESIS AND USES PROSCRIPT, INC. (US) 1996-05-09 — — WO disclosed
US-4108846-A FOR PRODUCTION OF POLYPEPTIDES HOFFMANN-LA ROCHE INC. 1978-08-22 — — 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 (5 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-20110275597-A1 PHARMACEUTICAL COMPOSITION BCAT2, TTR, BCAT1 ALDH1A1 2807/4885TSHR 1287/4885CXCR4 2211/4885
US-20150290277-A1 PHARMACEUTICAL COMPOSITION BCAT2, TTR, BCAT1 ALDH1A1 2807/4885TSHR 1287/4885CXCR4 2211/4885
US-20150072942-A1 BORONIC ESTER AND ACID COMPOUNDS, SYNTHESIS AND USES BCL6, BCAP31, CD79B ALDH1A1 3283/4885TSHR 2235/4885CXCR4 343/4885
US-20110306560-A1 BORONIC ESTER AND ACID COMPOUNDS, SYNTHESIS AND USES BCL6, BCAP31, CD79B ALDH1A1 3283/4885TSHR 2235/4885CXCR4 343/4885
US-20130310320-A1 BORONIC ESTER AND ACID COMPOUNDS, SYNTHESIS AND USES BCL6, BCAP31, CD79B ALDH1A1 3283/4885TSHR 2235/4885CXCR4 343/4885

“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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