SCHEMBL7269774

SCHEMBL7269774

Cc1ccc(S(=O)(=O)OC[C@@H](C)OC2CCCCO2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC12A2 P55011 1/20 0.39
SLC12A5 Q9H2X9 1/20 0.39
TP53 P04637 1/20 0.37
TSHR P16473 3/20 0.36
HTT P42858 2/20 0.36
HSD17B10 Q99714 2/20 0.36
ALDH1A1 P00352 3/20 0.35
CYP3A4 P08684 1/20 0.35
ENPP3 O14638 2/20 0.35
ENPP1 P22413 2/20 0.35
ENPP2 Q13822 2/20 0.35
CHRM2 P08172 1/20 0.35
CHRM1 P11229 1/20 0.35
GAA P10253 3/20 0.35
POLB P06746 1/20 0.35
CYP2D6 P10635 2/20 0.34
CYP1A2 P05177 1/20 0.34
LMNA P02545 1/20 0.34
ALOX12 P18054 1/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL3641091 1.00 SLC12A2 (0.39) SLC12A2SLC12A5TP53TSHRHTT
SCHEMBL8154423 1.00 SLC12A2 (0.39) SLC12A2SLC12A5TP53TSHRHTT
SCHEMBL3641089 1.00 SLC12A2 (0.39) SLC12A2SLC12A5TP53TSHRHTT
SCHEMBL7269764 1.00 SLC12A2 (0.39) SLC12A2SLC12A5TP53TSHRHTT
SCHEMBL9334967 0.91 SLC12A2 (0.37) SLC12A2SLC12A5TP53TSHRHTT
SCHEMBL18729643 0.89 SLC12A2 (0.39) SLC12A2SLC12A5TP53TSHRHTT
SCHEMBL9626662 0.88 SLC12A2 (0.37) SLC12A2SLC12A5TP53TSHRHTT
SCHEMBL27032127 0.88 SLC12A2 (0.37) SLC12A2SLC12A5TP53TSHRHTT
SCHEMBL27130489 0.88 SLC12A2 (0.37) SLC12A2SLC12A5TP53TSHRHTT
SCHEMBL27031979 0.88 SLC12A2 (0.37) SLC12A2SLC12A5TP53TSHRHTT

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2895167-B1 AMINO-QUINOLINES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2018-12-05 EP disclosed
US-9216965-B2 Amino-quinolines as kinase inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2015-12-22 US disclosed
US-9216965-B2 Amino-quinolines as kinase inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2015-12-22 US disclosed
US-9216965-B2 Amino-quinolines as kinase inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2015-12-22 US disclosed
US-9187450-B2 Substituted pyridine compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-11-17 US disclosed
EP-2592076-B1 SUBSTITUTED PYRIDINE COMPOUND DAIICHI SANKYO CO LTD (JP) 2015-05-13 EP disclosed
US-20150094333-A1 AMINO-QUINOLINES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2015-04-02 US disclosed
US-20150094333-A1 AMINO-QUINOLINES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2015-04-02 US disclosed
US-20150094333-A1 AMINO-QUINOLINES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2015-04-02 US disclosed
US-20140213549-A9 Substituted Pyridine Compound UBE INDUSTRIES, LTD. (JP) 2014-07-31 US disclosed
US-20130109653-A1 Substituted Pyridine Compound UBE INDUSTRIES, LTD. (JP) 2013-05-02 US disclosed
US-20090105208-A1 Substituted Piperazines as CB1 Antagonists SCHERING CORPORATION 2009-04-23 US disclosed
US-20080318904-A1 DEUTERIUM-ENRICHED TENOFOVIR PROTIA, LLC (US) 2008-12-25 US disclosed
US-20080318904-A1 DEUTERIUM-ENRICHED TENOFOVIR PROTIA, LLC (US) 2008-12-25 US disclosed
WO-2008157657-A1 DEUTERIUM-ENRICHED TENOFOVIR PROTIA LLC (US) 2008-12-24 WO disclosed
US-6653296-B1 2-phosphonomethoxypropyl derivatives of purine and pyrimidine bases INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) 2003-11-25 US disclosed
US-6057305-A Antiretroviral enantiomeric nucleotide analogs INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) 2000-05-02 US disclosed
EP-0897917-A1 Compounds for use in the preparation of antiretroviral enantiomeric nucleotide analogs INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) 1999-02-24 EP disclosed
EP-0654037-A1 ANTIRETROVIRAL ENANTIOMERIC NUCLEOTIDE ANALOGS INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) 1995-05-24 EP disclosed
WO-1994003467-A2 ANTIRETROVIRAL ENANTIOMERIC NUCLEOTIDE ANALOGS INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) 1994-02-17 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150094333-A1 AMINO-QUINOLINES AS KINASE INHIBITORS MAP3K3, ABL1, MAP3K20 SLC12A2 3939/4885SLC12A5 3858/4885TP53 1003/4885
US-20140213549-A9 Substituted Pyridine Compound CETP, MTTP, PRCP SLC12A2 1543/4885SLC12A5 1120/4885TP53 3244/4885
US-20080318904-A1 DEUTERIUM-ENRICHED TENOFOVIR DCTD, SAMHD1, SLC28A1 SLC12A2 609/4885SLC12A5 481/4885TP53 2228/4885
US-20090105208-A1 Substituted Piperazines as CB1 Antagonists CNR1, CNR2, GPR119 SLC12A2 2195/4885SLC12A5 2164/4885TP53 4048/4885
US-20130109653-A1 Substituted Pyridine Compound CETP, MTTP, PRCP SLC12A2 1543/4885SLC12A5 1120/4885TP53 3244/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.