1,4-Butanediol

1,4-Butanediol

SCHEMBL8910988

OC1CCC(O)CC1.OCCCCO.OCCO

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.39
SHBG P04278 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
EPHX2 P34913 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
1,4-Butanediol SCHEMBL8910983 0.94 TSHR (0.35) TSHRSHBGSMN1; SMN2LMNAALDH1A1
1,6-Hexanediol SCHEMBL27420700 0.93 TSHR (0.40) TSHRSHBGSMN1; SMN2LMNAALDH1A1
SCHEMBL8508682 0.93 TSHR (0.40) TSHRSHBGSMN1; SMN2LMNAALDH1A1
Ethylene Glycol SCHEMBL23716760 0.89 TSHR (0.47) TSHRSHBGEPHX2
Cyclohexanol SCHEMBL21925166 0.81 TSHR (0.59) TSHRSMN1; SMN2LMNAALDH1A1HSD17B10
SCHEMBL4814734 0.81 SIGMAR1 (0.33) TSHRSHBGLMNA
SCHEMBL382008 0.77 CNR2 (0.34) TSHRSHBGLMNA
1,4-Butanediol SCHEMBL3681996 0.76 SMN1; SMN2 (0.37) TSHRSMN1; SMN2LMNAALDH1A1HSD17B10
Cyclopentanol SCHEMBL7894966 0.76 TSHR (0.71) TSHRSHBG
Cyclohexanol SCHEMBL7709108 0.73 TSHR (0.67) TSHRSHBG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5681655-A MODIFIED AROMATIC POLYESTER SINCO ENGINEERING S.P.A. (IT) 1997-10-28 US disclosed
EP-0697040-A1 FIBRES WITH HIGH ELASTIC MODULUS FROM POLYESTER RESINS SINCO ENGINEERING S.P.A. (IT) 1996-02-21 EP disclosed
WO-1994026961-A1 FIBRES WITH HIGH ELASTIC MODULUS FROM POLYESTER RESINS M.& G. RICERCHE S.P.A. (IT) 1994-11-24 WO disclosed