SCHEMBL7159573

SCHEMBL7159573

CCCCCCCCCCCCc1ccc2c(c1)CCOO2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.41
SLC6A4 P31645 3/20 0.41
HTR2A P28223 3/20 0.41
HTR2C P28335 2/20 0.41
DRD2 P14416 1/20 0.41
ESR1 P03372 2/20 0.40
ADRA2A P08913 2/20 0.40
ADORA3 P0DMS8 2/20 0.40
TACR2 P21452 2/20 0.40
SLC6A3 Q01959 2/20 0.40
S1PR1 P21453 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
SHBG P04278 1/20 0.40
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40
HSPD1 P10809 1/20 0.40
ADRB3 P13945 1/20 0.40
HSPE1 P61604 1/20 0.40

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
SCHEMBL7159798 1.00 SLC6A2 (0.41) SLC6A2SLC6A4HTR2AHTR2CDRD2
SCHEMBL7161094 1.00 SLC6A2 (0.41) SLC6A2SLC6A4HTR2AHTR2CDRD2
SCHEMBL9059073 0.94 SKP2 (0.39) SLC6A2SLC6A4HTR2AHTR2CDRD2
SCHEMBL7159772 0.92 SLC6A2 (0.40) SLC6A2SLC6A4HTR2AHTR2CDRD2
SCHEMBL7160512 0.92 SLC6A2 (0.40) SLC6A2SLC6A4HTR2AHTR2CDRD2
SCHEMBL7154930 0.92 SLC6A2 (0.40) SLC6A2SLC6A4HTR2AHTR2CDRD2
SCHEMBL3259875 0.88 SLC6A2 (0.40) SLC6A2SLC6A4HTR2AHTR2CDRD2
SCHEMBL11696008 0.85 PPARA (0.43) SLC6A2SLC6A4HTR2AHTR2CDRD2
SCHEMBL18601204 0.85 ALOX5 (0.44) SLC6A2SLC6A4HTR2AHTR2CDRD2
SCHEMBL229771 0.85 FUT7 (0.36) HIF1ACHRM5CHRM1

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
EP-0945452-B1 SUGAR COMPOUNDS, GELLING AGENTS, GELLING AGENT COMPOSITIONS, PROCESSES FOR THE PREPARATION OF THEM, AND GEL COMPOSITIONS NEW JAPAN CHEM CO LTD (JP) 2003-11-19 EP disclosed
US-6187842-B1 REACTING SORBITOL OR XYLITOL WITH BENZALDEHYE IN PRESENCE OF ACID CATALYST NEW JAPAN CHEMICAL CO., LTD. (JP) 2001-02-13 US disclosed
EP-0945452-A1 SUGAR COMPOUNDS, GELLING AGENTS, GELLING AGENT COMPOSITIONS, PROCESSES FOR THE PREPARATION OF THEM, AND GEL COMPOSITIONS NEW JAPAN CHEMICAL CO.,LTD. (JP) 1999-09-29 EP disclosed