1,4-Butanediol

1,4-Butanediol

SCHEMBL871698

C=C(C)COCC(=C)C.OCCCCO

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 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
Ethylene Glycol SCHEMBL631461 0.88 HSD17B10 (0.35) ALDH1A1HSD17B10TSHRTDP1
SCHEMBL1576747 0.87 CES2 (0.39) SMN1; SMN2LMNAALDH1A1HSD17B10MEN1
SCHEMBL2790873 0.85 CES2 (0.42) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL2793665 0.85 CES2 (0.42) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL8533909 0.85 MEN1 (0.40) SMN1; SMN2MEN1KMT2ATSHR
SCHEMBL8537833 0.85 MEN1 (0.40) SMN1; SMN2MEN1KMT2ATSHR
SCHEMBL608739 0.85
SCHEMBL1576797 0.84
Di(Hydroxyethyl)Ether SCHEMBL631146 0.81 TSHR (0.53) SMN1; SMN2LMNAALDH1A1HSD17B10MEN1
SCHEMBL10031351 0.80 MEN1 (0.40) MEN1KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2451283-B1 INSECTICIDE-COATED SUBSTRATE FOR PROTECTING HUMANS AND PETS BASF SE (DE) 2017-06-21 EP disclosed
EP-2618661-A2 METHOD FOR PROTECTING LIVING PLANTS AGAINST HARMFUL INSECTS USING A SHEET-LIKE STRUCTURE BASF SE (DE) 2013-07-31 EP disclosed
EP-2451283-A2 INSECTICIDE-COATED SUBSTRATE FOR PROTECTING HUMANS AND PETS BASF SE (DE) 2012-05-16 EP disclosed
WO-2012038460-A2 METHOD FOR PROTECTING LIVING PLANTS AGAINST HARMFUL INSECTS USING A SHEET-LIKE STRUCTURE BASF SE (DE) 2012-03-29 WO disclosed
WO-2011003845-A2 INSECTICIDE-COATED SUBSTRATE FOR PROTECTING HUMANS AND PETS BASF SE (DE) 2011-01-13 WO disclosed
US-5786493-A SILYNATION OF UNSATURATED ALCOHOL, CYCLIZATION AND SOLVOLYSIS HUELS AKTIENGESELLSCHAFT (DE) 1998-07-28 US disclosed