SCHEMBL7246724

SCHEMBL7246724

CN1CCC2CCc3ccncc3C21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.43
CHRNB2 P17787 2/20 0.43
CHRNA4 P43681 2/20 0.43
CHRNA7 P36544 1/20 0.43
FDPS P14324 1/20 0.43

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
SCHEMBL7246721 1.00 ACHE (0.43) ACHECHRNB2CHRNA4CHRNA7FDPS
SCHEMBL29422947 1.00 ACHE (0.43) ACHECHRNB2CHRNA4CHRNA7FDPS
SCHEMBL7246720 1.00 ACHE (0.43) ACHECHRNB2CHRNA4CHRNA7FDPS
SCHEMBL7240759 0.88 ACHE (0.46) ACHE
SCHEMBL7240762 0.88 ACHE (0.46) ACHE
SCHEMBL7240765 0.88 ACHE (0.46) ACHE
SCHEMBL3819190 0.86 CHRNB2 (0.38) ACHECHRNB2CHRNA4CHRNA7
Hydrochloric Acid SCHEMBL52345 0.85 CHRNB2 (0.37) ACHECHRNB2CHRNA4CHRNA7
Hydrochloric Acid SCHEMBL3134497 0.85 CHRNB2 (0.37) ACHECHRNB2CHRNA4CHRNA7
SCHEMBL4541235 0.75 ACHE (0.39) ACHECHRNB2CHRNA4CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210145818-A1 COMPOSITIONS INFUSED WITH NICOTINE COMPOUNDS AND METHODS OF USE THEREOF Poviva Corp. 2021-05-20 US claimed
EP-3781163-A1 COMPOSITIONS INFUSED WITH NICOTINE COMPOUNDS AND METHODS OF USE THEREOF Poviva Corp. (US) 2021-02-24 EP claimed
WO-2019202396-A1 COMPOSITIONS INFUSED WITH NICOTINE COMPOUNDS AND METHODS OF USE THEREOF POVIVA TEA, LLC (US) 2019-10-24 WO claimed
US-10080747-B2 Nicotinic attenuation of CNS inflammation and autoimmunity DIGNITY HEALTH (US) 2018-09-25 US claimed
US-9566273-B2 Nicotinic attenuation of CNS inflammation and autoimmunity DIGNITY HEALTH (US) 2017-02-14 US claimed
US-20230094827-A1 NANOEMULSION COMPOSITIONS COMPRISING BIOLOGICALLY ACTIVE INGREDIENTS POVIVA CORP 2023-03-30 US disclosed
US-20220160731-A1 COMPOSITIONS COMPRISING BIOLOGICALLY ACTIVE AGENTS AND BILE SALTS POVIVA CORP 2022-05-26 US disclosed
EP-3972584-A1 NANOEMULSION COMPOSITIONS COMPRISING BIOLOGICALLY ACTIVE INGREDIENTS Poviva Corp. (US) 2022-03-30 EP disclosed
EP-3972582-A1 COMPOSITIONS COMPRISING BIOLOGICALLY ACTIVE AGENTS AND BILE SALTS Poviva Corp. (US) 2022-03-30 EP disclosed
US-20210145841-A1 ENHANCEMENT OF DELIVERY OF LIPOPHILIC ACTIVE AGENTS ACROSS THE BLOOD-BRAIN BARRIER AND METHODS FOR TREATING CENTRAL NERVOUS SYSTEM DISORDERS Poviva Corp. 2021-05-20 US disclosed
US-20210145818-A1 COMPOSITIONS INFUSED WITH NICOTINE COMPOUNDS AND METHODS OF USE THEREOF Poviva Corp. 2021-05-20 US disclosed
US-20210145036-A1 LIPOPHILIC ACTIVE AGENT INFUSED COMPOSITIONS WITH REDUCED FOOD EFFECT Poviva Corp. 2021-05-20 US disclosed
EP-3781163-A1 COMPOSITIONS INFUSED WITH NICOTINE COMPOUNDS AND METHODS OF USE THEREOF Poviva Corp. (US) 2021-02-24 EP disclosed
WO-2020236798-A1 NANOEMULSION COMPOSITIONS COMPRISING BIOLOGICALLY ACTIVE INGREDIENTS Poviva Corp. (US) 2020-11-26 WO disclosed
WO-2020236802-A1 COMPOSITIONS COMPRISING BIOLOGICALLY ACTIVE AGENTS AND BILE SALTS Poviva Corp. (US) 2020-11-26 WO disclosed
WO-2019202396-A1 COMPOSITIONS INFUSED WITH NICOTINE COMPOUNDS AND METHODS OF USE THEREOF POVIVA TEA, LLC (US) 2019-10-24 WO disclosed
WO-2019204502-A1 LIPOPHILIC ACTIVE AGENT INFUSED COMPOSITIONS WITH REDUCED FOOD EFFECT POVIVA TEA, LLC (US) 2019-10-24 WO disclosed
US-20150238640-A1 METHOD FOR PREPARING A MARKED PURINE DERIVATIVE, SAID DERIVATIVE AND USES THEREOF COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2015-08-27 US disclosed
US-6503922-B2 Central nervous system (CNS); bridged nicotine analogs of N-octylnicotinium iodide (NONI) having selective antagonist properties at alpha 3 beta 2-containing nicotinic receptor subtypes UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2003-01-07 US disclosed
US-20020099069-A1 Bridged nicotine compounds for use in the treatment of CNS pathologies KENTUCKY RESEARCH FOUNDATION, UNIVERSITY OF 2002-07-25 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 (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-20020099069-A1 Bridged nicotine compounds for use in the treatment of CNS pathologies CHRNB2, CHRNA5, CHRNA2 ACHE 94/4885CHRNB2 1/4885CHRNA4 10/4885
US-20210145036-A1 LIPOPHILIC ACTIVE AGENT INFUSED COMPOSITIONS WITH REDUCED FOOD EFFECT LIPC, PNLIP, LIPA ACHE 1419/4885CHRNB2 4527/4885CHRNA4 4395/4885
US-20210145818-A1 COMPOSITIONS INFUSED WITH NICOTINE COMPOUNDS AND METHODS OF USE THEREOF CHRNA5, SLC18A3, CHRNA6 ACHE 20/4885CHRNB2 8/4885CHRNA4 9/4885
US-20210145841-A1 ENHANCEMENT OF DELIVERY OF LIPOPHILIC ACTIVE AGENTS ACROSS THE BLOOD-BRAIN BARRIER AND METHODS FOR TREATING CENTRAL NERVOUS SYSTEM DISORDERS FABP7, LIPA, LIPC ACHE 4/4885CHRNB2 381/4885CHRNA4 636/4885
US-20150238640-A1 METHOD FOR PREPARING A MARKED PURINE DERIVATIVE, SAID DERIVATIVE AND USES THEREOF TPMT, NUDT1, DUT ACHE 3717/4885CHRNB2 4367/4885CHRNA4 3945/4885
US-20220160731-A1 COMPOSITIONS COMPRISING BIOLOGICALLY ACTIVE AGENTS AND BILE SALTS SLC10A2, ABCB11, SLC10A1 ACHE 873/4885CHRNB2 3555/4885CHRNA4 4664/4885
US-20230094827-A1 NANOEMULSION COMPOSITIONS COMPRISING BIOLOGICALLY ACTIVE INGREDIENTS PNLIP, LIPA, SGMS2 ACHE 279/4885CHRNB2 2696/4885CHRNA4 3923/4885

“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.