1,4-Butanediol

1,4-Butanediol

SCHEMBL5053409

O=C=Nc1c(O)ccc(Cc2ccc(O)c(N=C=O)c2N=C=O)c1N=C=O.OCCCCO

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37
BCHE P06276 3/20 0.33
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
CA2 P00918 1/20 0.30
ACHE P22303 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
SCHEMBL753897 0.91 GABRA1 (0.42) GABRA1GABRB2CYP3A4TSHR
SCHEMBL7102166 0.75 GABRA1 (0.55) GABRA1GABRB2CYP3A4TSHR
SCHEMBL10798784 0.69 GABRA1 (0.42) GABRA1GABRB2CYP3A4TSHR
1,4-Butanediol SCHEMBL15372833 0.69 CYP3A4 (0.41) GABRA1GABRB2CYP3A4TSHR
SCHEMBL7626712 0.67 CYP3A4 (0.42) GABRA1GABRB2CYP3A4TSHR
SCHEMBL11855962 0.65 GABRA1 (0.50) GABRA1GABRB2CYP3A4TSHRCA2
SCHEMBL29574102 0.65 GABRA1 (0.75) GABRA1GABRB2CYP3A4TSHR
SCHEMBL754997 0.65 GABRA1 (0.75) GABRA1GABRB2CYP3A4TSHR
SCHEMBL11697004 0.63 GABRA1 (0.36) GABRA1GABRB2CYP3A4TSHR
SCHEMBL467385 0.62 GABRA1 (0.57) GABRA1GABRB2CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8633261-B2 Polymer composites having particles with mixed organic modifications THE UNIVERSITY OF QUEENSLAND (AU) 2014-01-21 US disclosed
US-8293812-B2 Containing thermoplastic resin having solid particles dispersed throughout; controlling particle size; modulus; high tensile strength The University of Queensland St. Lucia (AU) 2012-10-23 US disclosed
US-20110060072-A1 POLYMER COMPOSITES HAVING PARTICLES WITH MIXED ORGANIC MODIFICATIONS THE UNIVERSITY OF QUEENSLAND (AU) 2011-03-10 US disclosed
US-20080281016-A1 Polymer Composite MILLER WASTE MILLS INC. DBA RTP COMPANY 2008-11-13 US disclosed
WO-2006024068-A1 POLYMER COMPOSITE THE UNIVERSITY OF QUEENSLAND (AU) 2006-03-09 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 (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-20110060072-A1 POLYMER COMPOSITES HAVING PARTICLES WITH MIXED ORGANIC MODIFICATIONS PUF60, PCBP1, LCP1 GABRA1 4073/4885GABRB2 4616/4885BCHE 4042/4885

“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.