Barbital

Barbital

SCHEMBL4525046

CCC1(CC)C(=O)NC(=O)NC1=O.OB(O)O

nearest known ligand 0.81

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.81
TP53 P04637 1/20 0.45
ALDH1A1 P00352 4/20 0.44
HSD17B10 Q99714 2/20 0.41
KDM4E B2RXH2 1/20 0.39
CYP3A4 P08684 1/20 0.39
GABRB3 P28472 1/20 0.39
OPRD1 P41143 1/20 0.39
GABRA2 P47869 1/20 0.39
GABRB2 P47870 1/20 0.39
MMP9 P14780 6/20 0.36
MMP2 P08253 5/20 0.36
MMP8 P22894 5/20 0.36
MMP13 P45452 4/20 0.36
MMP3 P08254 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34

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
Barbital SCHEMBL43818 0.90 LMNA (1.00) LMNATP53ALDH1A1HSD17B10KDM4E
Barbital SCHEMBL3859278 0.90 LMNA (1.00) LMNATP53ALDH1A1HSD17B10KDM4E
Barbital SCHEMBL2128102 0.87 LMNA (0.94) LMNATP53ALDH1A1HSD17B10KDM4E
Barbital SCHEMBL7592317 0.87 LMNA (0.94) LMNATP53ALDH1A1HSD17B10KDM4E
Barbital SCHEMBL11328233 0.87 LMNA (0.94) LMNATP53ALDH1A1HSD17B10KDM4E
Barbital SCHEMBL23533431 0.87 LMNA (0.94) LMNATP53ALDH1A1HSD17B10KDM4E
Barbital SCHEMBL236590 0.87 LMNA (0.94) LMNATP53ALDH1A1HSD17B10KDM4E
Barbital SCHEMBL11328256 0.87 LMNA (0.94) LMNATP53ALDH1A1HSD17B10KDM4E
Barbital SCHEMBL21084914 0.87 LMNA (0.94) LMNATP53ALDH1A1HSD17B10KDM4E
Barbital SCHEMBL21084955 0.87 LMNA (0.94) LMNATP53ALDH1A1HSD17B10KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7541385-B2 Bronchodilating β-agonist compositions and methods MYLAN TECHNOLOGIES, INC. 2009-06-02 US disclosed
US-20070166236-A1 BRONCHODILATING BETA-AGONIST COMPOSITIONS AND METHODS DEY, L.P. (US) 2007-07-19 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-20070166236-A1 BRONCHODILATING BETA-AGONIST COMPOSITIONS AND METHODS ADRB2, ADRB3, ADRB1 LMNA 1033/4885TP53 4799/4885ALDH1A1 2085/4885

“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.