Secobarbital

Secobarbital

SCHEMBL614906

C=CCC1(C(C)CCC)C(=O)NC(=O)NC1=O.[NaH]

nearest known ligand 0.97

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQ

The experimentally established mechanism targets of Secobarbital. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GABRB3 known ✓ P28472 1/20 0.65
GABRA2 known ✓ P47869 1/20 0.65
GABRB2 known ✓ P47870 1/20 0.65
MMP9 P14780 1/20 0.97
CYP3A4 P08684 3/20 0.65
KDM4E B2RXH2 1/20 0.65
ALDH1A1 P00352 1/20 0.65
OPRD1 P41143 1/20 0.65
NR1I2 O75469 1/20 0.60
LMNA P02545 4/20 0.53
RECQL P46063 1/20 0.35
CYP19A1 P11511 1/20 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
Secobarbital SCHEMBL41182 1.00 MMP9 (0.97) MMP9CYP3A4KDM4EALDH1A1GABRB3
Secobarbital SCHEMBL7599361 1.00 MMP9 (0.97) MMP9CYP3A4KDM4EALDH1A1GABRB3
Secobarbital SCHEMBL80734 0.98 MMP9 (1.00) MMP9CYP3A4KDM4EALDH1A1GABRB3
Secobarbital SCHEMBL41181 0.98 MMP9 (1.00) MMP9CYP3A4KDM4EALDH1A1GABRB3
Secobarbital SCHEMBL80735 0.98 MMP9 (1.00) MMP9CYP3A4KDM4EALDH1A1GABRB3
Secobarbital SCHEMBL8085730 0.98 MMP9 (1.00) MMP9CYP3A4KDM4EALDH1A1GABRB3
Secobarbital SCHEMBL28198576 0.95 MMP9 (0.94) MMP9CYP3A4KDM4EALDH1A1GABRB3
Secobarbital SCHEMBL7778384 0.90 MMP9 (0.83) MMP9CYP3A4KDM4EALDH1A1GABRB3
Thiamylal SCHEMBL34747 0.89 MMP9 (0.77) MMP9CYP3A4KDM4EALDH1A1GABRB3
Thiamylal SCHEMBL548050 0.87 MMP9 (0.79) MMP9CYP3A4KDM4EALDH1A1GABRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116179496-A Hybridoma cell strain secreting anti-phenobarbital drug monoclonal multi-residue antibody and application thereof 江南大学 2023-05-30 CN claimed
EP-2748000-B1 KIT COMPRISING A PACKAGING MATERIAL AND A SOLID PHARMACEUTICAL OR NUTRACEUTICAL PRODUCT CONTAINED IN THE PACKAGING MATERIAL SIEGFRIED LTD (CH) 2020-11-18 EP claimed
US-9414988-B2 Kit comprising a packaging material and a solid pharmaceutical or nutraceutical product contained in the packaging material SIEGFRIED LTD. (CH) 2016-08-16 US claimed
US-20140190866-A1 KIT COMPRISING A PACKAGING MATERIAL AND A SOLID PHARMACEUTICAL OR NUTRACEUTICAL PRODUCT CONTAINED IN THE PACKAGING MATERIAL SIEGFRIED LTD. (CH) 2014-07-10 US claimed
EP-2748000-A1 KIT COMPRISING A PACKAGING MATERIAL AND A SOLID PHARMACEUTICAL OR NUTRACEUTICAL PRODUCT CONTAINED IN THE PACKAGING MATERIAL Siegfried Ltd. (CH) 2014-07-02 EP claimed
WO-2013034273-A1 KIT COMPRISING A PACKAGING MATERIAL AND A SOLID PHARMACEUTICAL OR NUTRACEUTICAL PRODUCT CONTAINED IN THE PACKAGING MATERIAL SIEGFRIED LTD. (CH) 2013-03-14 WO claimed
EP-1317304-B1 SLOW RELEASE PHARMACEUTICAL PREPARATION AND METHOD OF ADMINISTERING SAME PALMAYA PTY LTD (AU) 2011-04-27 EP claimed
US-6309669-B1 Therapeutic treatment and prevention of infections with a bioactive materials encapsulated within a biodegradable-biocompatible polymeric matrix THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY 2001-10-30 US claimed
US-3989823-A COMBATING SMOKING COSTANZO FRANCOIS DI 1976-11-02 US claimed
EP-4682141-A1 TRICYCLIC COMPOUND ONO Pharmaceutical Co., Ltd. (JP) 2026-01-21 EP disclosed
EP-4584371-A2 REPROGRAMMING TROPISM VIA DISPLAYED PEPTIDES TILING RECEPTOR-LIGANDS The Regents of the University of California (US) 2025-07-16 EP disclosed
CN-119855901-A Tiling receptor-ligand reprogramming chemotaxis via display peptides 加利福尼亚大学董事会 2025-04-18 CN disclosed
US-20250057823-A1 COMPOSITION FOR IMPROVING CARDIAC FUNCTION KYOTO UNIVERSITY (JP) 2025-02-20 US disclosed
CN-119233828-A Nano encapsulated pharmaceutical composition and use thereof 福君基因公司 2024-12-31 CN disclosed
US-3989823-A COMBATING SMOKING COSTANZO FRANCOIS DI 1976-11-02 US disclosed
US-3975237-A LIGANDS SYVA COMPANY (US) 1976-08-17 US disclosed
US-3966556-A Compounds for enzyme amplification assay methadone analogs SYVA COMPANY (US) 1976-06-29 US disclosed
US-3966764-A ELECTRON SPIN RESONANCE SYVA COMPANY (US) 1976-06-29 US disclosed
US-3966744-A Spin labeled compounds SYVA COMPANY (US) 1976-06-29 US disclosed
US-3954793-A INSECTICIDES HENNESSY DOUGLAS J 1976-05-04 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 (1 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-20250057823-A1 COMPOSITION FOR IMPROVING CARDIAC FUNCTION TNNI3, NPPA, TNNT2 GABRB3 2945/4885GABRA2 3925/4885GABRB2 3251/4885

“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.