Pentobarbital

Pentobarbital

SCHEMBL2376470

CCC[C@@H](C)C1(CC)C(=O)NC(=O)NC1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQ

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

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GABRB3 known ✓ P28472 1/20 1.00
GABRA2 known ✓ P47869 1/20 1.00
GABRB2 known ✓ P47870 1/20 1.00
CYP3A4 P08684 3/20 1.00
ALDH1A1 P00352 2/20 1.00
KDM4E B2RXH2 1/20 1.00
OPRD1 P41143 1/20 1.00
LMNA P02545 5/20 0.73
MMP9 P14780 4/20 0.67
RECQL P46063 1/20 0.49
NR1I2 O75469 1/20 0.43
POLB P06746 1/20 0.41
PKM P14618 1/20 0.41
CYP19A1 P11511 1/20 0.34
TP53 P04637 1/20 0.32
MMP2 P08253 2/20 0.32
MMP3 P08254 2/20 0.32

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
Pentobarbital SCHEMBL735353 1.00 CYP3A4 (1.00) CYP3A4ALDH1A1KDM4EGABRB3OPRD1
Pentobarbital SCHEMBL24966 1.00 CYP3A4 (1.00) CYP3A4ALDH1A1KDM4EGABRB3OPRD1
Pentobarbital SCHEMBL26057 0.98 CYP3A4 (0.96) CYP3A4ALDH1A1KDM4EGABRB3OPRD1
Pentobarbital SCHEMBL4207760 0.98 CYP3A4 (0.96) CYP3A4ALDH1A1KDM4EGABRB3OPRD1
Pentobarbital SCHEMBL7639355 0.98 CYP3A4 (0.96) CYP3A4ALDH1A1KDM4EGABRB3OPRD1
Pentobarbital SCHEMBL1256614 0.98 CYP3A4 (0.96) CYP3A4ALDH1A1KDM4EGABRB3OPRD1
Pentobarbital SCHEMBL3695587 0.98 CYP3A4 (0.96) CYP3A4ALDH1A1KDM4EGABRB3OPRD1
Pentobarbital SCHEMBL26056 0.98 CYP3A4 (0.96) CYP3A4ALDH1A1KDM4EGABRB3OPRD1
Pentobarbital SCHEMBL3245534 0.98 CYP3A4 (0.96) CYP3A4ALDH1A1KDM4EGABRB3OPRD1
Pentobarbital SCHEMBL30173355 0.98 CYP3A4 (0.96) CYP3A4ALDH1A1KDM4EGABRB3OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200187851-A1 PERIODONTAL DISEASE STRATIFICATION AND USES THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2020-06-18 US claimed
US-12454520-B2 Protein degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2025-10-28 US disclosed
US-20250214969-A1 PROTEIN DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2025-07-03 US disclosed
US-20250179130-A1 METHODS AND SYSTEMS FOR DESIGNING AND/OR CHARACTERIZING SOLUBLE LIPIDATED LIGAND AGENTS ON TARGET THERAPEUTICS LLC 2025-06-05 US disclosed
US-12303549-B2 Methods of treating or inhibiting onset of Huntington's disease UNIVERSITY OF ROCHESTER (US) 2025-05-20 US disclosed
US-20250144158-A1 SLEEP IMPROVEMENT METHOD USING LIMOSILACTOBACILLUS REUTERI STRAIN LM1063 KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2025-05-08 US disclosed
CN-119546319-A Composition for improving sleep or maintaining deep sleep comprising lactobacillus reuteri LM1063 strain as an active ingredient and use thereof 乐土美森有限公司 2025-02-28 CN disclosed
WO-2024195982-A2 COMPOSITION FOR IMPROVING SLEEP OR MAINTAINING SOUND SLEEP COMPRISING LIMOSILACTOBACILLUS REUTERI LM1063 STRAIN AS ACTIVE INGREDIENT, AND USE THEREOF 주식회사 락토메이슨 2024-09-26 WO disclosed
US-12060397-B2 Soluble lipidated ligand agents for treating eye inflammation TUFTS MEDICAL CENTER (US) 2024-08-13 US disclosed
US-12006329-B2 Protein degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2024-06-11 US disclosed
EP-0064445-A1 N-substituted 2,4-dialkoxybenzene sulfon amides CHOAY S.A. (FR) 1982-11-10 EP disclosed
EP-0064006-A1 Substituted 2,4-dialkoxybenzenesulfonyl chlorides CHOAY S.A. (FR) 1982-11-03 EP disclosed
US-4060637-A 5-BROMO-N-(N,N'-DIALKYLAMINOALKYL)-O-CRESOTAMIDES PIERRE FABRE SA (FR) 1977-11-29 US disclosed
US-4048316-A Composition for antagonizing the narcotic effects of barbiturate addiction and withdrawal effects, and for treatment of barbiturate poisoning PENN NATHAR W 1977-09-13 US disclosed
US-4029808-A Thienyl phenyl O-(aminoalkyl)-ketone oxime and furyl phenyl O-(aminoalkyl)-ketone oxime coronary vasodilators C.E.R.P.H.A. A FRENCH SOCIETY ORGANISED UNDER THE LAWS OF FRANCE (FR) 1977-06-14 US disclosed
US-3969529-A Phenoxyacetic acid derivatives as diuretic agents C.E.R.P.H.A. (FR) 1976-07-13 US disclosed
US-3958002-A ADMINISTERING PIERRE FABRE S.A. (FR) 1976-05-18 US disclosed
US-3951979-A HYPOTENSIVE, ANTIEMETIC, ANTITUSSIVE MAUVERNARY ROLAND YVES 1976-04-20 US disclosed
US-3941878-A ASPIRIN, A CRESOTAMIDE PIERRE FABRE S.A. (FR) 1976-03-02 US disclosed
US-3940490-A N-ALKYL-5-BROMO-ORTHO-CRESOTAMIDES, ANTICONVULSANT PIERRE FABRE S.A. (FR) 1976-02-24 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 (5 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-12006329-B2 Protein degraders and uses thereof MDM2, CUL1, PSMG3 GABRB3 4269/4885GABRA2 3816/4885GABRB2 4207/4885
US-12454520-B2 Protein degraders and uses thereof MDM2, CUL1, PSMG3 GABRB3 4269/4885GABRA2 3816/4885GABRB2 4207/4885
US-20250214969-A1 PROTEIN DEGRADERS AND USES THEREOF MDM2, CUL1, PSMG3 GABRB3 4269/4885GABRA2 3816/4885GABRB2 4207/4885
US-20250179130-A1 METHODS AND SYSTEMS FOR DESIGNING AND/OR CHARACTERIZING SOLUBLE LIPIDATED LIGAND AGENTS LDLR, HDLBP, LIPG GABRB3 3591/4885GABRA2 1997/4885GABRB2 3410/4885
US-12060397-B2 Soluble lipidated ligand agents for treating eye inflammation LIPG, CD40, LDLR GABRB3 3575/4885GABRA2 2590/4885GABRB2 3185/4885

“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.