Nicotine

Nicotine

SCHEMBL407606

CN1CCC[C@H]1c1cccnc1.[H+]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CHRNA4CHRNB2

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 known ✓ P17787 4/20 1.00
CHRNA4 known ✓ P43681 4/20 1.00
ALDH1A1 P00352 5/20 1.00
CHRNA7 P36544 4/20 1.00
CHRNB4 P30926 3/20 1.00
CHRNA3 P32297 3/20 1.00
CHRNA2 Q15822 2/20 1.00
LMNA P02545 1/20 1.00
TDP1 Q9NUW8 1/20 1.00
HTR3E A5X5Y0 1/20 1.00
PSIP1 O75475 1/20 1.00
TRPA1 O75762 1/20 1.00
HTR3B O95264 1/20 1.00
CHRNA1 P02708 1/20 1.00
CHRNG P07510 1/20 1.00
MAPT P10636 1/20 1.00
CHRNB1 P11230 1/20 1.00
CYP2A6 P11509 1/20 1.00
PTGS1 P23219 1/20 1.00
CHRNA5 P30532 1/20 1.00

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
(+/-)Nicotine SCHEMBL20193 1.00 ALDH1A1 (1.00) ALDH1A1CHRNA7CHRNB2CHRNA4CHRNB4
R-Nicotine SCHEMBL20518 1.00 ALDH1A1 (1.00) ALDH1A1CHRNA7CHRNB2CHRNA4CHRNB4
Nicotine SCHEMBL10909351 1.00 ALDH1A1 (1.00) ALDH1A1CHRNA7CHRNB2CHRNA4CHRNB4
Nicotine SCHEMBL308101 1.00 ALDH1A1 (1.00) ALDH1A1CHRNA7CHRNB2CHRNA4CHRNB4
(+/-)Nicotine SCHEMBL11976729 1.00 ALDH1A1 (1.00) ALDH1A1CHRNA7CHRNB2CHRNA4CHRNB4
Nicotine SCHEMBL4729900 1.00 ALDH1A1 (1.00) ALDH1A1CHRNA7CHRNB2CHRNA4CHRNB4
(+/-)Nicotine SCHEMBL10909353 1.00 ALDH1A1 (1.00) ALDH1A1CHRNA7CHRNB2CHRNA4CHRNB4
(+/-)Nicotine SCHEMBL1724652 1.00 ALDH1A1 (1.00) ALDH1A1CHRNA7CHRNB2CHRNA4CHRNB4
Nicotine SCHEMBL2599622 1.00 ALDH1A1 (1.00) ALDH1A1CHRNA7CHRNB2CHRNA4CHRNB4
(+/-)Nicotine SCHEMBL797620 1.00 ALDH1A1 (1.00) ALDH1A1CHRNA7CHRNB2CHRNA4CHRNB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1461037-B1 PROCESS FOR PREPARATION OF A BEVERAGE TREATED WITH A NICOTINE CONTAINING SUBSTANCE KNIGHT JOSEPH ROBERT (US) 2007-08-01 EP claimed
CN-114200032-B Method for detecting nicotine form in tobacco material and method for judging type of acid added in tobacco material 湖南中烟工业有限责任公司 2024-02-23 CN disclosed
US-20230014009-A1 BENEFIT AGENT DELIVERY SYSTEM UTILIZING AN ELECTRIC FIELD E INK CORPORATION 2023-01-19 US disclosed
CN-114200032-A Method for detecting nicotine form in tobacco material and method for judging type of acid added in tobacco material 湖南中烟工业有限责任公司 2022-03-18 CN disclosed
EP-2619175-A1 ENHANCED TRANSBUCCAL DRUG DELIVERY SYSTEM AND COMPOSITIONS NexMed Holdings, Inc. (US) 2013-07-31 EP disclosed
US-20130178463-A1 ENHANCED TRANSBUCCAL DRUG DELIVERY SYSTEM AND COMPOSITIONS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2013-07-11 US disclosed
WO-2012039775-A1 ENHANCED TRANSBUCCAL DRUG DELIVERY SYSTEM AND COMPOSITIONS NEXMED HOLDINGS, INC. (US) 2012-03-29 WO disclosed
US-20120017924-A1 COATED NICOTINE-CONTAINING CHEWING GUM, MANUFACTURE AND USE THEREOF MCNEIL AB (SE) 2012-01-26 US disclosed
EP-1404306-B1 A COATED NICOTINE-CONTAINING CHEWING GUM, MANUFACTURE AND USE THEREOF MCNEIL AB (SE) 2010-10-20 EP disclosed
EP-2152314-A1 COATED ORAL NICOTINE FORMULATION BUFFERED WITH AMINO ACID McNeil AB (SE) 2010-02-17 EP disclosed
CN-100500143-C Buluoweima slow-release tablet and its preparing method LI ZHANG (CN) 2009-06-17 CN disclosed
EP-2023928-A1 COATED PHARMACEUTICAL PRODUCT FOR INTRAORAL DELIVERY OF NICOTINE COMPRISING TROMETAMOL AS BUFFERING AGENT McNeil AB (SE) 2009-02-18 EP disclosed
WO-2008140372-A1 COATED ORAL NICOTINE FORMULATION BUFFERED WITH AMINO ACID MCNEIL AB (SE) 2008-11-20 WO disclosed
US-20080286341-A1 Buffered coated nicotine containing products ANDERSSON SVEN-BORJE 2008-11-20 US disclosed
US-7387788-B1 Pharmaceutical compositions of nicotine and methods of use thereof ANTARES PHARMA IPL AG (CH) 2008-06-17 US disclosed
WO-2007133141-A1 COATED PHARMACEUTICAL PRODUCT FOR INTRAORAL DELIVERY OF NICOTINE COMPRISING TROMETAMOL AS BUFFERING AGENT MCNEIL AB (SE) 2007-11-22 WO disclosed
US-20070269492-A1 New product and use and manufacture thereof MCNEIL-PPC, INC 2007-11-22 US disclosed
CN-1868466-A Buluoweima slow-release tablet and its preparing method ZHANG LI (CN) 2006-11-29 CN disclosed
EP-0229710-A2 Improvements in or relating to the chemical analysis of tobacco or smoking-related products IMPERIAL TOBACCO LIMITED (GB) 1987-07-22 EP disclosed
US-4579858-A AQUEOUS SOLUTION OF NICOTINE AND A THICKENING AGENT AKTIEBOLAGET LEO (SE) 1986-04-01 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-20130178463-A1 ENHANCED TRANSBUCCAL DRUG DELIVERY SYSTEM AND COMPOSITIONS ACMSD, SLC6A6, SLC1A5 CHRNB2 563/4885CHRNA4 1274/4885ALDH1A1 3207/4885

“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.