SCHEMBL3620776

SCHEMBL3620776

N[C@@H]1CN(C(=O)O)C[C@@H]1N

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 1/20 0.39
SLC6A12 P48065 3/20 0.35
SLC6A11 P48066 3/20 0.35
SLC6A13 Q9NSD5 3/20 0.35
CHRNA7 P36544 1/20 0.31
GRM6 O15303 2/20 0.30
GRM2 Q14416 2/20 0.30
GRM3 Q14832 2/20 0.30

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
SCHEMBL19816446 1.00 GABRR1 (0.39) GABRR1SLC6A12SLC6A11SLC6A13CHRNA7
SCHEMBL3620778 1.00 GABRR1 (0.39) GABRR1SLC6A12SLC6A11SLC6A13CHRNA7
SCHEMBL4627762 1.00 GABRR1 (0.39) GABRR1SLC6A12SLC6A11SLC6A13CHRNA7
SCHEMBL3832575 1.00 GABRR1 (0.39) GABRR1SLC6A12SLC6A11SLC6A13CHRNA7
SCHEMBL18957048 0.85 GABRR1 (0.33) GABRR1SLC6A12SLC6A11SLC6A13
SCHEMBL841973 0.85 GABRR1 (0.33) GABRR1SLC6A12SLC6A11SLC6A13
SCHEMBL4609252 0.85 GABRR1 (0.33) GABRR1SLC6A12SLC6A11SLC6A13
SCHEMBL505726 0.85 GABRR1 (0.33) GABRR1SLC6A12SLC6A11SLC6A13
SCHEMBL18555595 0.85 GABRR1 (0.33) GABRR1SLC6A12SLC6A11SLC6A13
SCHEMBL5403763 0.85 GABRR1 (0.33) GABRR1SLC6A12SLC6A11SLC6A13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11926613-B2 Kinase inhibitors for the treatment of central and peripheral nervous system disorders UNIVERSITY OF MIAMI (US) 2024-03-12 US disclosed
US-20230140395-A1 NOVEL IMIDAZOLE DERIVATIVE HAVING PROTEIN KINASE INHIBITORY ACTIVITY, AND USE THEREOF INDUSTRY-UNIVERSITY COOPERATION FOUNDATION HANYANG UNIVERSITY ERICA CAMPUS (KR) 2023-05-04 US disclosed
US-20210163444-A1 KINASE INHIBITORS FOR THE TREATMENT OF CENTRAL AND PERIPHERAL NERVOUS SYSTEM DISORDERS UNIVERSITY OF MIAMI 2021-06-03 US disclosed
CN-111801322-A Kinase inhibitors for the treatment of central and peripheral nervous system disorders 迈阿密大学 2020-10-20 CN disclosed
EP-3704103-A1 KINASE INHIBITORS FOR THE TREATMENT OF CENTRAL AND PERIPHERAL NERVOUS SYSTEM DISORDERS University of Miami (US) 2020-09-09 EP disclosed
EP-1978804-B1 AMINOCYCLOHEXANES AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS FOR THE TREATMENT OR PREVENTION OF DIABETES MERCK SHARP & DOHME (US) 2014-07-30 EP disclosed
US-7750034-B2 Aminocyclohexanes as dipeptidyl peptidase-IV inhibitors for the treatment or prevention of diabetes MERCK SHARP & DOHME CORP. (US) 2010-07-06 US disclosed
US-20090270467-A1 Aminocyclohexanes as Dipeptidyl Peptidase-IV Inhibitors for the Treatment or Prevention of Diabetes MERCK & CO., INC. (US) 2009-10-29 US disclosed
EP-1978804-A2 AMINOCYCLOHEXANES AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS FOR THE TREATMENT OR PREVENTION OF DIABETES Merck & Co., Inc. (US) 2008-10-15 EP disclosed
WO-2007087231-A2 AMINOCYCLOHEXANES AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS FOR THE TREATMENT OR PREVENTION OF DIABETES MERCK & CO., INC. (US) 2007-08-02 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 (4 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-20090270467-A1 Aminocyclohexanes as Dipeptidyl Peptidase-IV Inhibitors for the Treatment or Prevention of Diabetes DPP4, DPP3, DPP7 GABRR1 4387/4885SLC6A12 2180/4885SLC6A11 2144/4885
US-20210163444-A1 KINASE INHIBITORS FOR THE TREATMENT OF CENTRAL AND PERIPHERAL NERVOUS SYSTEM DISORDERS PNCK, PYGB, PMP22 GABRR1 376/4885SLC6A12 3150/4885SLC6A11 1099/4885
US-11926613-B2 Kinase inhibitors for the treatment of central and peripheral nervous system disorders PNCK, PYGB, PMP22 GABRR1 376/4885SLC6A12 3150/4885SLC6A11 1099/4885
US-20230140395-A1 NOVEL IMIDAZOLE DERIVATIVE HAVING PROTEIN KINASE INHIBITORY ACTIVITY, AND USE THEREOF MAPKAPK3, MAPK3, MAP3K3 GABRR1 1792/4885SLC6A12 4197/4885SLC6A11 2780/4885

“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.