Ethylene Glycol

Ethylene Glycol

SCHEMBL11090532

O=C(CCCN1CCC2(CC1)CN(c1ccc(F)cc1)c1ccccc12)c1ccc(F)cc1.OCCO

nearest known ligand 0.76

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.76
SLC18A3 Q16572 2/20 0.76
DRD2 P14416 10/20 0.56
HTR2A P28223 4/20 0.53
HTR2B P41595 3/20 0.53
HTR2C P28335 2/20 0.53
TSHR P16473 2/20 0.51
DRD3 P35462 4/20 0.51
DRD4 P21917 2/20 0.51
HTR7 P34969 2/20 0.50
CYP1A2 P05177 2/20 0.50
CYP3A4 P08684 2/20 0.50
HTR1A P08908 2/20 0.50
ADRA2A P08913 2/20 0.50
CYP2D6 P10635 2/20 0.50
ADRA2B P18089 2/20 0.50
ADRA2C P18825 2/20 0.50
SLC6A4 P31645 2/20 0.50
ADRA1A P35348 2/20 0.50
HRH1 P35367 2/20 0.50

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
SCHEMBL11270088 0.97 SIGMAR1 (0.81) SIGMAR1SLC18A3DRD2HTR2AHTR2B
Maleic Acid SCHEMBL11088205 0.92 SIGMAR1 (0.72) SIGMAR1SLC18A3DRD2HTR2AHTR2B
Fumaric Acid SCHEMBL11088213 0.92 SIGMAR1 (0.72) SIGMAR1SLC18A3DRD2HTR2AHTR2B
SCHEMBL11475634 0.87 SIGMAR1 (1.00) SIGMAR1SLC18A3DRD2HTR2AHTR2B
SCHEMBL11480152 0.82 SIGMAR1 (0.83) SIGMAR1SLC18A3DRD2HTR2AHTR2B
Hydrochloric Acid SCHEMBL11481362 0.82 SIGMAR1 (0.81) SIGMAR1SLC18A3DRD2HTR2AHTR2B
SCHEMBL11473027 0.76 SLC18A3 (0.69) SIGMAR1SLC18A3DRD2HTR2ATSHR
SCHEMBL11474458 0.76 SIGMAR1 (0.63) SIGMAR1SLC18A3DRD2HTR2AHTR2B
SCHEMBL9052827 0.74 DRD2 (0.80) SIGMAR1SLC18A3DRD2HTR2AHTR2B
SCHEMBL11085101 0.74 AKT1 (0.49) SIGMAR1SLC18A3ADRA2CNPC1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4477667-A Spiro[indoline-3,4'-piperidine]s and related compounds AMERICAN HOECHST CORPORATION (US) 1984-10-16 US disclosed
US-4408050-A Spiro(indoline-3,4'-piperidine) and related compounds AMERICAN HOECHST CORPORATION (US) 1983-10-04 US disclosed
US-4379932-A Process for preparing spiro[indoline-3,4'-piperidine]s AMERICAN HOECHST CORPORATION (US) 1983-04-12 US disclosed
US-4379933-A Process for preparing spiro[indoline-3,4'-piperidine]s AMERICAN HOECHST CORPORATION (US) 1983-04-12 US disclosed
US-4345081-A Spiro[indoline-3,4'-piperidine]s AMERICAN HOECHST CORPORATION (US) 1982-08-17 US disclosed
US-4307235-A Spiro[indoline-3,4'-piperidine]s AMERICAN HOECHST CORPORATION (US) 1981-12-22 US disclosed
US-4209625-A Spiro[indoline-3,4'-piperidine]s AMERICAN HOECHST CORPORATION (US) 1980-06-24 US disclosed