SCHEMBL6897411

SCHEMBL6897411

NC1C2CCC(C2)C1c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.64
CHRNA3 P32297 2/20 0.64
CHRNA7 P36544 2/20 0.64
MAOB P27338 8/20 0.45
MAOA P21397 7/20 0.45
KDM1A O60341 5/20 0.45
CYP2C19 P33261 4/20 0.45
CYP2B6 P20813 3/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2D6 P10635 2/20 0.45
CYP2C9 P11712 2/20 0.45
LMNA P02545 2/20 0.45
TAAR1 Q96RJ0 2/20 0.45
CYP3A4 P08684 1/20 0.45
HTR1A P08908 1/20 0.45
ADRA2A P08913 1/20 0.45
CYP2A6 P11509 1/20 0.45
SLC6A2 P23975 1/20 0.45
HTR2C P28335 1/20 0.45
ADRA1A P35348 1/20 0.45

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
SCHEMBL24583885 1.00 CHRNB2 (0.64) CHRNB2CHRNA3CHRNA7MAOBMAOA
SCHEMBL24584736 1.00 CHRNB2 (0.64) CHRNB2CHRNA3CHRNA7MAOBMAOA
SCHEMBL24584739 1.00 CHRNB2 (0.64) CHRNB2CHRNA3CHRNA7MAOBMAOA
Hydrochloric Acid SCHEMBL8040240 0.98 CHRNB2 (0.62) CHRNB2CHRNA3CHRNA7MAOBMAOA
Hydrochloric Acid SCHEMBL8040234 0.98 CHRNB2 (0.62) CHRNB2CHRNA3CHRNA7MAOBMAOA
SCHEMBL11780910 0.87 CHRNB2 (0.49) CHRNB2CHRNA3CHRNA7MAOBMAOA
SCHEMBL19359148 0.81 MAOB (0.46) CHRNB2CHRNA3CHRNA7MAOBMAOA
SCHEMBL10886603 0.80 CHRNB2 (0.65) CHRNB2CHRNA3CHRNA7TAAR1HTR2C
SCHEMBL8313378 0.74 MAOB (0.46) MAOBMAOAKDM1ACYP2C19CYP2B6
SCHEMBL11789056 0.71 MAOB (0.48) MAOBMAOAKDM1ACYP2C19CYP2B6

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-12023308-B2 Agents for reversing toxic proteinopathies THE BROAD INSTITUTE, INC. (US) 2024-07-02 US disclosed
US-12023308-B2 Agents for reversing toxic proteinopathies THE BROAD INSTITUTE, INC. (US) 2024-07-02 US disclosed
US-11919836-B2 Prodrugs of fencamfamine Praxis Bioresearch, LLC (US) 2024-03-05 US disclosed
WO-2022140654-A1 COMPOSITIONS AND METHODS RELATED TO BICYCLO[2.2.1] HEPTANAMINE-CONTAINING COMPOUNDS THE BROAD INSTITUTE, INC. (US) 2022-06-30 WO disclosed
US-20220023233-A1 AGENTS FOR REVERSING TOXIC PROTEINOPATHIES THE BROAD INSTITUTE, INC. (US) 2022-01-27 US disclosed
US-11207278-B2 Agents for reversing toxic proteinopathies THE BROAD INSTITUTE, INC. (US) 2021-12-28 US disclosed
US-20210169827-A1 AGENTS FOR REVERSING TOXIC PROTEINOPATHIES THE BROAD INSTITUTE, INC. (US) 2021-06-10 US disclosed
US-20200399203-A1 PRODRUGS OF FENCAMFAMINE PRAXIS BIORESEARCH, INC. 2020-12-24 US disclosed
US-10662146-B2 Prodrugs of fencamfamine Praxis Bioresearch, LLC (US) 2020-05-26 US disclosed
US-20190023650-A1 PRODRUGS OF FENCAMFAMINE Praxis Bioresearch, LLC 2019-01-24 US disclosed
US-6706747-B2 TREATING ELEVATED INTRAOCULAR PRESSURE, DEPRESSION, NON INSULIN-DEPENDENT DIABETES, MALE IMPOTENCE AND OBESITY WHICH IS ALLEVIATED BY TREATMENT WITH AN ALPHA 2 BLOCKING AGENT ALLERGAN, INC. 2004-03-16 US disclosed
US-20030187047-A1 Conformationally rigid bicyclic and adamantane derivatives useful as alpha2-adrenergic blocking agents ALLERGAN SALES, INC. 2003-10-02 US disclosed
US-6569884-B2 Trans-2-(3-phenyl-bicyclo(2.2.1)heptyl)-2-aminooxazoline, for example; treating intraocular pressure, noninsulin-dependent diabetes, male impotence and obesity ALLERGAN 2003-05-27 US disclosed
US-20020049241-A1 Conformationally rigid bicyclic and adamantane derivatives useful as alpha2-adrenergic blocking agents ALLERGAN SALES, INC. 2002-04-25 US disclosed
EP-0770068-B1 CONFORMATIONALLY RIGID BICYCLIC AND ADAMANTANE DERIVATIVES USEFUL AS ALPHA 2-ADRENERGIC BLOCKING AGENTS ALLERGAN SALES INC (US) 2001-11-28 EP disclosed
US-6319935-B1 USED IN TREATMENT OF ELEVATED INTRAOCULAR PRESSURE, NON INSULIN-DEPENDENT DIABETES, MALE IMPOTENCE AND OBESITY ALLERGAN SALES, INC. 2001-11-20 US disclosed
US-6150389-A ANTIDEPRESSANTS; TREATING ELEVATED INTRAOCULAR PRESSURE, E.G., GLAUCOMA; ANTIDIABETIC AGENTS FOR NON-INSULIN DEPENDENT DIABETES, SEXUAL DISORDERS, E.G., MALE IMPOTENCE AND OBESITY; E.G. TRANS-2-(3-PHENYL-BICYCLO(2.2.1)HEPTYL)-2-AMINOOXAZOLINE ALLERGAN SALES, INC. (US) 2000-11-21 US disclosed
US-5731337-A Conformationally rigid bicycle and adamantane derivatives useful as α2 ALLERGAN (US) 1998-03-24 US disclosed
EP-0770068-A1 CONFORMATIONALLY RIGID BICYCLIC AND ADAMANTANE DERIVATIVES USEFUL AS ALPHA 2-ADRENERGIC BLOCKING AGENTS Allergan (US) 1997-05-02 EP disclosed
WO-1996001813-A1 CONFORMATIONALLY RIGID BICYCLIC AND ADAMANTANE DERIVATIVES USEFUL AS α2-ADRENERGIC BLOCKING AGENTS ALLERGAN (US) 1996-01-25 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 (10 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-20210169827-A1 AGENTS FOR REVERSING TOXIC PROTEINOPATHIES MUC1, TMIGD3, TMED9 CHRNB2 2960/4885CHRNA3 3657/4885CHRNA7 3439/4885
US-20020049241-A1 Conformationally rigid bicyclic and adamantane derivatives useful as alpha2-adrenergic blocking agents ADRB2, ADRB1, ADRA1B CHRNB2 45/4885CHRNA3 90/4885CHRNA7 61/4885
US-11919836-B2 Prodrugs of fencamfamine FOLR2, FOLR1, CYP4F2 CHRNB2 1221/4885CHRNA3 1098/4885CHRNA7 1114/4885
US-11207278-B2 Agents for reversing toxic proteinopathies MUC1, TMIGD3, TMED9 CHRNB2 2960/4885CHRNA3 3657/4885CHRNA7 3439/4885
US-20030187047-A1 Conformationally rigid bicyclic and adamantane derivatives useful as alpha2-adrenergic blocking agents ADRB2, ADRB1, ADRA1B CHRNB2 45/4885CHRNA3 90/4885CHRNA7 61/4885
US-12023308-B2 Agents for reversing toxic proteinopathies MUC1, TMIGD3, TMED9 CHRNB2 2960/4885CHRNA3 3657/4885CHRNA7 3439/4885
US-20190023650-A1 PRODRUGS OF FENCAMFAMINE FOLR2, FOLR1, CYP4F2 CHRNB2 1221/4885CHRNA3 1098/4885CHRNA7 1114/4885
US-10662146-B2 Prodrugs of fencamfamine FEN1, PNMT, SLC19A1 CHRNB2 520/4885CHRNA3 411/4885CHRNA7 410/4885
US-20200399203-A1 PRODRUGS OF FENCAMFAMINE FOLR2, FOLR1, CYP4F2 CHRNB2 1221/4885CHRNA3 1098/4885CHRNA7 1114/4885
US-20220023233-A1 AGENTS FOR REVERSING TOXIC PROTEINOPATHIES MUC1, TMIGD3, TMED9 CHRNB2 2960/4885CHRNA3 3657/4885CHRNA7 3439/4885

“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.