Phenobarbital

Phenobarbital

SCHEMBL2592325

CCC1(c2ccccc2)C(=O)NC(=O)NC1=O.CCC1(c2ccccc2)C(=O)NC(=O)NC1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 6/20 0.80
MMP9 P14780 6/20 0.80
MMP3 P08254 3/20 0.80
KMT2A Q03164 2/20 0.68
MEN1 O00255 1/20 0.68
CYP1A2 P05177 1/20 0.68
POLB P06746 1/20 0.68
TSHR P16473 1/20 0.68
APEX1 P27695 1/20 0.68
TDP1 Q9NUW8 1/20 0.68
LMNA P02545 3/20 0.62
CYP2C19 P33261 1/20 0.55
MMP13 P45452 2/20 0.53
MMP8 P22894 1/20 0.50
CACNA1F O60840 1/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
CYP2C9 P11712 1/20 0.47
HTR2A P28223 1/20 0.47
HRH1 P35367 1/20 0.47

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
Phenobarbital SCHEMBL16583 1.00 MMP2 (0.80) MMP2MMP9MMP3KMT2AMEN1
Phenobarbital SCHEMBL18825042 1.00 MMP2 (0.80) MMP2MMP9MMP3KMT2AMEN1
Phenobarbital SCHEMBL28099657 1.00 MMP2 (0.80) MMP2MMP9MMP3KMT2AMEN1
Phenobarbital SCHEMBL3475428 0.98 MMP2 (0.77) MMP2MMP9MMP3KMT2AMEN1
Phenobarbital SCHEMBL22032658 0.98 MMP2 (0.77) MMP2MMP9MMP3KMT2AMEN1
Phenobarbital SCHEMBL4193755 0.98 MMP2 (0.77) MMP2MMP9MMP3KMT2AMEN1
Phenobarbital SCHEMBL1322895 0.98 MMP2 (0.77) MMP2MMP9MMP3KMT2AMEN1
Phenobarbital SCHEMBL352763 0.98 MMP2 (0.77) MMP2MMP9MMP3KMT2AMEN1
Phenobarbital SCHEMBL6807467 0.98 MMP2 (0.77) MMP2MMP9MMP3KMT2AMEN1
Phenobarbital SCHEMBL2120028 0.98 MMP2 (0.77) MMP2MMP9MMP3KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112083115-B Kit for detecting residual quantity of 7 barbiturates in raw milk 上海市农产品质量安全中心 2023-06-13 CN disclosed
EP-3631000-A1 RAPID SAMPLE TEMPERATURE CHANGING FOR ASSAYING Essenlix Corporation (US) 2020-04-08 EP disclosed
WO-2018217953-A1 RAPID SAMPLE TEMPERATURE CHANGING FOR ASSAYING ESSENLIX CORPORATION (US) 2018-11-29 WO disclosed
WO-2018148342-A1 COMPRESSED OPEN FLOW ASSAY AND USE ESSENLIX CORPORATION (US) 2018-08-16 WO disclosed
EP-2564340-A2 PATHWAY RECOGNITION ALGORITHM USING DATA INTEGRATION ON GENOMIC MODELS (PARADIGM) The Regents of the University of California (US) 2013-03-06 EP disclosed
WO-2011139345-A2 PATHWAY RECOGNITION ALGORITHM USING DATA INTEGRATION ON GENOMIC MODELS (PARADIGM) THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-11-10 WO disclosed
US-7670612-B2 Supplying active materials in various phases in single dosage multicompartment capsule INNERCAP TECHNOLOGIES, INC. (US) 2010-03-02 US disclosed
EP-1620569-A4 A FORWARD MUTATION ASSAY BASED ON 5-FLUOROURACIL RESISTANCE MERCK & CO INC (US) 2008-06-18 EP disclosed
EP-1620569-A2 A FORWARD MUTATION ASSAY BASED ON 5-FLUOROURACIL RESISTANCE Merck & Co., Inc. (US) 2006-02-01 EP disclosed
WO-2004096987-A2 A FORWARD MUTATION ASSAY BASED ON 5-FLUOROURACIL RESISTANCE MERCK & CO., INC. (US) 2004-11-11 WO disclosed
EP-0745222-A4 COMPETITIVE BINDING ASSAYS HAVING IMPROVED LINEARITY BOEHRINGER MANNHEIM CORP (US) 1998-11-25 EP disclosed
US-5795566-A Deodorant compositions containing at least two aldehydes and the deodorant products containing them ROBERTET S.A. (FR) 1998-08-18 US disclosed
EP-0828745-A1 CONVERSION OF DEEP INTERNAL OLEFINS INTO PRIMARY ALKYL ALUMINUM COMPOUNDS BY ISOMERIZATION-DISPLACEMENT ALBEMARLE CORPORATION (US) 1998-03-18 EP disclosed
EP-0745222-A1 COMPETITIVE BINDING ASSAYS HAVING IMPROVED LINEARITY BOEHRINGER MANNHEIM CORPORATION (US) 1996-12-04 EP disclosed
WO-1996019732-A1 COMPETITIVE BINDING ASSAYS HAVING IMPROVED LINEARITY MICROGENICS CORPORATION (US) 1996-06-27 WO disclosed