SCHEMBL13835366

SCHEMBL13835366

C#Cc1ccc2c(c1)C(c1ccccc1F)=NCc1c(-c3nc(C(C)C)no3)ncn1-2

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GABRA3 P34903 7/20 0.63
GABRG2 P18507 6/20 0.63
GABRB3 P28472 6/20 0.63
GABRA1 P14867 3/20 0.53
GABRA5 P31644 3/20 0.53
GABRA2 P47869 3/20 0.53
GABRA6 Q16445 2/20 0.53
GABRB2 P47870 1/20 0.49

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
SCHEMBL7721717 0.89 GABRG2 (0.64) GABRA3GABRG2GABRB3GABRA1GABRA5
SCHEMBL29692345 0.89 GABRA3 (0.76) GABRA3GABRG2GABRB3GABRA1GABRA5
SCHEMBL13009537 0.89 GABRA3 (0.76) GABRA3GABRG2GABRB3GABRA1GABRA5
SCHEMBL13061672 0.88
SCHEMBL13061673 0.87 GABRA3 (0.81) GABRA3GABRG2GABRB3GABRA1GABRA5
SCHEMBL7724642 0.87 GABRA3 (0.77) GABRA3GABRG2GABRB3GABRA1GABRA5
SCHEMBL30056689 0.84 GABRA5 (0.59) GABRA3GABRG2GABRB3GABRA1GABRA5
SCHEMBL22717284 0.84 GABRA5 (0.59) GABRA3GABRG2GABRB3GABRA1GABRA5
SCHEMBL30056839 0.84 GABRA5 (0.59) GABRA3GABRG2GABRB3GABRA1GABRA5
SCHEMBL19922802 0.79 GABRA3 (0.73) GABRA3GABRG2GABRB3GABRA1GABRA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11753412-B2 Treatment of cognitive and mood symptoms in neurodegenerative and neuropsychiatric disorders with Alpha5-containing GABAA receptor agonists UWM RESEARCH FOUNDATION, INC. (US) 2023-09-12 US disclosed
US-11753412-B2 Treatment of cognitive and mood symptoms in neurodegenerative and neuropsychiatric disorders with Alpha5-containing GABAA receptor agonists UWM RESEARCH FOUNDATION, INC. (US) 2023-09-12 US disclosed
EP-4129297-A1 TREATMENT OF COGNITIVE AND MOOD SYMPTOMS IN NEURODEGENERATIVE AND NEUROPSYCHIATRIC DISORDERS WITH ALPHA5-CONTAINING GABAA RECEPTOR AGONISTS UWM Research Foundation, Inc. (US) 2023-02-08 EP disclosed
US-20210309662-A1 TREATMENT OF COGNITIVE AND MOOD SYMPTOMS IN NEURODEGENERATIVE AND NEUROPSYCHIATRIC DISORDERS WITH ALPHA5-CONTAINING GABAA RECEPTOR AGONISTS CENTRE FOR ADDICTION AND MENTAL HEALTH (CA) 2021-10-07 US disclosed
US-10906909-B2 Treatment of cognitive and mood symptoms in neurodegenerative and neuropsychiatric disorders with ALPHA5-containing GABAA receptor agonists UWM RESEARCH FOUNDATION, INC. (US) 2021-02-02 US disclosed
US-20200181146-A1 TREATMENT OF COGNITIVE AND MOOD SYMPTOMS IN NEURODEGENERATIVE AND NEUROPSYCHIATRIC DISORDERS WITH ALPHA5-CONTAINING GABAA RECEPTOR AGONISTS UWM RESEARCH FOUNDATION, INC. 2020-06-11 US disclosed
WO-2017161370-A1 TREATMENT OF COGNITIVE AND MOOD SYMPTOMS IN NEURODEGENERATIVE AND NEUROPSYCHIATRIC DISORDERS WITH ALPHA5-CONTAINING GABAA RECEPTOR AGONISTS UWM RESEACH FOUNDATION, INC. (US) 2017-09-21 WO disclosed
US-9597342-B2 GABAergic receptor subtype selective ligands and their uses UWM RESEARCH FOUNDATION, INC. (US) 2017-03-21 US disclosed
US-20150258128-A1 GABAERGIC RECEPTOR SUBTYPE SELECTIVE LIGANDS AND THEIR USES UWM RESEARCH FOUNDATION, INC. 2015-09-17 US disclosed
US-9006233-B2 Gabaergic receptor subtype selective ligands and their uses UWM RESEARCH FOUNDATION, INC. (US) 2015-04-14 US disclosed
US-8835424-B2 Selective agents for pain suppression WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2014-09-16 US disclosed
US-20120295892-A1 GABAERGIC RECEPTOR SUBTYPE SELECTIVE LIGANDS AND THEIR USES UWM RESEARCH FOUNDATION, INC. (US) 2012-11-22 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 (6 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-11753412-B2 Treatment of cognitive and mood symptoms in neurodegenerative and neuropsychiatric disorders with Alpha5-containing GABAA receptor agonists GABRA5, CHRNA5, GABRA1 GABRA3 5/4885GABRG2 25/4885GABRB3 10/4885
US-20200181146-A1 TREATMENT OF COGNITIVE AND MOOD SYMPTOMS IN NEURODEGENERATIVE AND NEUROPSYCHIATRIC DISORDERS WITH ALPHA5-CONTAINING GABAA RECEPTOR AGONISTS GABRA5, CHRNA5, GABRA1 GABRA3 5/4885GABRG2 25/4885GABRB3 10/4885
US-20150258128-A1 GABAERGIC RECEPTOR SUBTYPE SELECTIVE LIGANDS AND THEIR USES GABRA3, GABRA2, GABRB3 GABRA3 1/4885GABRG2 10/4885GABRB3 3/4885
US-20210309662-A1 TREATMENT OF COGNITIVE AND MOOD SYMPTOMS IN NEURODEGENERATIVE AND NEUROPSYCHIATRIC DISORDERS WITH ALPHA5-CONTAINING GABAA RECEPTOR AGONISTS GABRA5, CHRNA5, GABRA1 GABRA3 5/4885GABRG2 25/4885GABRB3 10/4885
US-20120295892-A1 GABAERGIC RECEPTOR SUBTYPE SELECTIVE LIGANDS AND THEIR USES GABRA3, GABRA2, GABRB3 GABRA3 1/4885GABRG2 10/4885GABRB3 3/4885
US-10906909-B2 Treatment of cognitive and mood symptoms in neurodegenerative and neuropsychiatric disorders with ALPHA5-containing GABAA receptor agonists GABRA5, CHRNA5, GABRA1 GABRA3 5/4885GABRG2 25/4885GABRB3 10/4885

“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.