SCHEMBL4607771

SCHEMBL4607771

CCCCCCCCCCCCc1ccc(S(=O)(=O)OP(CCCC)(CCCC)(CCCC)CCCC)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.47
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA9 Q16790 1/20 0.45
ESR1 P03372 2/20 0.44
ADRA2A P08913 2/20 0.44
ADORA3 P0DMS8 2/20 0.44
TACR2 P21452 2/20 0.44
SLC6A2 P23975 2/20 0.44
SLC6A4 P31645 2/20 0.44
SLC6A3 Q01959 2/20 0.44
LMNA P02545 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
SHBG P04278 1/20 0.44
TP53 P04637 1/20 0.44
CYP3A4 P08684 1/20 0.44
HSPD1 P10809 1/20 0.44
ADRB3 P13945 1/20 0.44

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
SCHEMBL524732 0.84 MCHR1 (0.46) CA2SMN1; SMN2CA12CA9LMNA
SCHEMBL514092 0.84 MCHR1 (0.46) CA2SMN1; SMN2CA12CA9LMNA
SCHEMBL11589672 0.81 CA2 (0.64) CA2SMN1; SMN2CA12CA1CA9
SCHEMBL2323376 0.81 CA2 (0.64) CA2SMN1; SMN2CA12CA1CA9
Hydrochloric Acid SCHEMBL10968741 0.81 TDP1 (0.41) CA2CA12CA1CA9ALDH1A1
SCHEMBL4459094 0.80 TDP1 (0.42) CA2CA12CA1CA9ALDH1A1
SCHEMBL4456402 0.80 TDP1 (0.42) CA2CA12CA1CA9ALDH1A1
SCHEMBL3671895 0.80 GAA (0.44) CA2SMN1; SMN2CA12CA1CA9
SCHEMBL1638890 0.80 TDP1 (0.45) SMN1; SMN2ALDH1A1
SCHEMBL4248939 0.80 CA2 (0.62) CA2SMN1; SMN2CA12CA1CA9

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-1556437-B1 ANTISTATIC AGENTS AND POLYMER COMPOSITIONS DERIVED THEREFROM GEN ELECTRIC (US) 2008-07-30 EP disclosed
EP-1556437-A1 ANTISTATIC AGENTS AND POLYMER COMPOSITIONS DERIVED THEREFROM GENERAL ELECTRIC COMPANY (US) 2005-07-27 EP disclosed
US-6900257-B2 Antistatic agents and polymer compositions derived therefrom GENERAL ELECTRIC COMPANY (US) 2005-05-31 US disclosed
WO-2004013218-A1 ANTISTATIC AGENTS AND POLYMER COMPOSITIONS DERIVED THEREFROM GENERAL ELECTRIC COMPANY (US) 2004-02-12 WO disclosed
US-20040030015-A1 Antistatic agents and polymer compositions derived therefrom SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2004-02-12 US disclosed
EP-0678552-A1 Process for the preparation of modified polybutylene terephthalate resin POLYPLASTICS CO. LTD. (JP) 1995-10-25 EP disclosed