SCHEMBL6886940

SCHEMBL6886940

Cc1cnc2cc3c(cc2n1)C1CNCC3C1

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 8/20 0.70
▸ CHRNA4 P43681 8/20 0.70
▸ CHRNB4 P30926 2/20 0.64
▸ CHRNA3 P32297 2/20 0.64
▸ CHRNA1 P02708 1/20 0.64
▸ ESR1 P03372 1/20 0.64
▸ CHRNG P07510 1/20 0.64
▸ CHRNB1 P11230 1/20 0.64
▸ CHRNA5 P30532 1/20 0.64
▸ CHRNA7 P36544 1/20 0.64
▸ HTR3A P46098 1/20 0.64
▸ CHRND Q07001 1/20 0.64
▸ CHRNA2 Q15822 1/20 0.64

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
SCHEMBL29761231 1.00 CHRNB2 (0.70) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA1
SCHEMBL23153171 0.82 CHRNB2 (1.00) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA1
SCHEMBL14117078 0.82 CHRNB2 (0.62) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA1
SCHEMBL13285194 0.82 CHRNB2 (0.62) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA1
SCHEMBL21074660 0.81 CHRNB2 (0.58) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA1
SCHEMBL21074656 0.80 CHRNB2 (0.58) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA1
SCHEMBL21074782 0.79 CHRNB2 (0.55) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA1
SCHEMBL18117455 0.78 CHRNB2 (0.57) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA1
SCHEMBL15003906 0.78 CHRNB2 (0.57) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA1
SCHEMBL16343697 0.78 CHRNB2 (0.57) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130101630-A1 HIGHLY PURE VARENICLINE OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF SUBSTANTIALLY FREE OF METHYLVARENICLINE IMPURITY ACTAVIS GROUP PTC EHF (IS) 2013-04-25 — — US claimed
US-11872234-B2 Vareniciline compound and process of manufacture thereof PAR PHARMACEUTICAL, INC. (US) 2024-01-16 — — US disclosed
US-11872234-B2 Vareniciline compound and process of manufacture thereof PAR PHARMACEUTICAL, INC. (US) 2024-01-16 — — US disclosed
US-11779587-B2 Vareniciline compound and process of manufacture thereof PAR PHARMACEUTICAL, INC. (US) 2023-10-10 — — US disclosed
US-11779587-B2 Vareniciline compound and process of manufacture thereof PAR PHARMACEUTICAL, INC. (US) 2023-10-10 — — US disclosed
US-20230285407-A1 VARENICILINE COMPOUND AND PROCESS OF MANUFACTURE THEREOF WILMINGTON SAVINGS FUND SOCIETY, FSB, AS COLLATERAL AGENT 2023-09-14 — — US disclosed
US-20230285404-A1 VARENICLINE COMPOUND AND PROCESS OF MANUFACTURE THEREOF ENDO OPERATIONS LIMITED (IE) 2023-09-14 — — US disclosed
US-20230285407-A1 VARENICILINE COMPOUND AND PROCESS OF MANUFACTURE THEREOF WILMINGTON SAVINGS FUND SOCIETY, FSB, AS COLLATERAL AGENT 2023-09-14 — — US disclosed
US-20230285404-A1 VARENICLINE COMPOUND AND PROCESS OF MANUFACTURE THEREOF ENDO OPERATIONS LIMITED (IE) 2023-09-14 — — US disclosed
US-20230285406-A1 VARENICILINE COMPOUND AND PROCESS OF MANUFACTURE THEREOF WILMINGTON SAVINGS FUND SOCIETY, FSB, AS COLLATERAL AGENT 2023-09-14 — — US disclosed
US-20230285406-A1 VARENICILINE COMPOUND AND PROCESS OF MANUFACTURE THEREOF WILMINGTON SAVINGS FUND SOCIETY, FSB, AS COLLATERAL AGENT 2023-09-14 — — US disclosed
EP-4241775-A1 TABLET COMPRISING VARENICLINE AND PROCESS OF PREPARATION THEREOF Par Pharmaceutical, Inc. (US) 2023-09-13 — — EP disclosed
US-11717524-B1 Varenicline compound and process of manufacture thereof PAR PHARMACEUTICAL, INC. (US) 2023-08-08 — — US disclosed
US-11717524-B1 Varenicline compound and process of manufacture thereof PAR PHARMACEUTICAL, INC. (US) 2023-08-08 — — US disclosed
US-20130101630-A1 HIGHLY PURE VARENICLINE OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF SUBSTANTIALLY FREE OF METHYLVARENICLINE IMPURITY ACTAVIS GROUP PTC EHF (IS) 2013-04-25 — — US disclosed
US-20130101630-A1 HIGHLY PURE VARENICLINE OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF SUBSTANTIALLY FREE OF METHYLVARENICLINE IMPURITY ACTAVIS GROUP PTC EHF (IS) 2013-04-25 — — US disclosed
WO-2011110954-A1 HIGHLY PURE VARENICLINE OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF SUBSTANTIALLY FREE OF METHYLVARENICLINE IMPURITY ACTAVIS GROUP PTC EHF (IS) 2011-09-15 — — 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 (7 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-20230285407-A1 VARENICILINE COMPOUND AND PROCESS OF MANUFACTURE THEREOF COMT, CYP2C9, CYP3A7 CHRNB2 88/4885CHRNA4 82/4885CHRNB4 101/4885
US-11717524-B1 Varenicline compound and process of manufacture thereof COMT, CYP2C9, CYP3A7 CHRNB2 49/4885CHRNA4 41/4885CHRNB4 43/4885
US-20130101630-A1 HIGHLY PURE VARENICLINE OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF SUBSTANTIALLY FREE OF METHYLVARENICLINE IMPURITY PDE7A, CHRNA7, HTR7 CHRNB2 52/4885CHRNA4 48/4885CHRNB4 102/4885
US-11779587-B2 Vareniciline compound and process of manufacture thereof COMT, CYP2C9, CYP3A7 CHRNB2 88/4885CHRNA4 82/4885CHRNB4 101/4885
US-20230285404-A1 VARENICLINE COMPOUND AND PROCESS OF MANUFACTURE THEREOF COMT, CYP2C9, CYP3A7 CHRNB2 49/4885CHRNA4 41/4885CHRNB4 43/4885
US-11872234-B2 Vareniciline compound and process of manufacture thereof COMT, CYP2C9, CYP3A7 CHRNB2 88/4885CHRNA4 82/4885CHRNB4 101/4885
US-20230285406-A1 VARENICILINE COMPOUND AND PROCESS OF MANUFACTURE THEREOF COMT, CYP2C9, CYP3A7 CHRNB2 88/4885CHRNA4 82/4885CHRNB4 101/4885

“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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