SCHEMBL1962827

SCHEMBL1962827

CCC=CCCCS(=O)(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.50
ALDH1A1 P00352 6/20 0.44
CYP19A1 P11511 4/20 0.44
PPARA Q07869 4/20 0.44
F7 P08709 3/20 0.44
F3 P13726 3/20 0.44
PPARG P37231 3/20 0.44
OXER1 Q8TDS5 3/20 0.44
PTGS1 P23219 2/20 0.44
KMT2A Q03164 2/20 0.44
PPARD Q03181 2/20 0.44
ADORA3 P0DMS8 2/20 0.44
RXRA P19793 2/20 0.44
MAPT P10636 3/20 0.41
NR1I2 O75469 2/20 0.41
PTGS2 P35354 2/20 0.41
FFAR1 O14842 2/20 0.41
CYP3A4 P08684 2/20 0.41
ALOX15 P16050 2/20 0.41
HSD17B10 Q99714 2/20 0.41

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
SCHEMBL4073056 1.00 EPHX2 (0.50) EPHX2ALDH1A1CYP19A1PPARAF7
SCHEMBL4076228 1.00 EPHX2 (0.50) EPHX2ALDH1A1CYP19A1PPARAF7
SCHEMBL8072218 0.91 EPHX2 (0.60) EPHX2ALDH1A1CYP19A1PPARAF7
SCHEMBL8072057 0.91 EPHX2 (0.60) EPHX2ALDH1A1CYP19A1PPARAF7
SCHEMBL17784473 0.86 EPHX2 (0.54) EPHX2PPARAAPPFAAH
SCHEMBL9777764 0.86 EPHX2 (0.54) EPHX2PPARAAPPFAAH
SCHEMBL9777768 0.86 EPHX2 (0.54) EPHX2PPARAAPPFAAH
SCHEMBL28517631 0.86 ALDH1A1 (0.56) EPHX2ALDH1A1CYP19A1PPARAF7
SCHEMBL4082941 0.86 ALDH1A1 (0.56) EPHX2ALDH1A1CYP19A1PPARAF7
SCHEMBL10978361 0.86 EPHX2 (0.41) EPHX2ALDH1A1CYP19A1PPARAF7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160256567-A1 COMPOSITIONS AND METHODS FOR DELIVERING MESSENGER RNA PROTIVA BIOTHERAPEUTICS, INC. (CA) 2016-09-08 US disclosed
US-9206206-B2 Oxidized lipid compounds and uses thereof VASCULAR BIOGENICS LTD. (IL) 2015-12-08 US disclosed
CN-104788492-A Oxidized lipid compounds and uses thereof VASCULAR BIOGENICS LTD 2015-07-22 CN disclosed
CN-102271517-B Oxidized lipid compounds and uses thereof VASCULAR BIOGENICS LTD 2015-04-08 CN disclosed
EP-2826369-A2 Oxidized lipid compounds and uses thereof Vascular Biogenics Ltd. (IL) 2015-01-21 EP disclosed
EP-2826370-A2 Oxidized lipid compounds and uses thereof Vascular Biogenics Ltd. (IL) 2015-01-21 EP disclosed
EP-2348866-B1 OXIDIZED LIPID COMPOUNDS AND USES THEREOF VASCULAR BIOGENICS LTD (IL) 2015-01-07 EP disclosed
US-20130203707-A1 Oxidized Lipid Compounds and Uses Thereof VASCULAR BIOGENICS LTD. (IL) 2013-08-08 US disclosed
CN-102271517-A oxidized lipid compounds and uses thereof 2011-12-07 CN disclosed
US-20110207703-A1 OXIDIZED LIPID COMPOUNDS AND USES THEREOF VASCULAR BIOGENICS LTD. (IL) 2011-08-25 US disclosed
EP-2348866-A1 OXIDIZED LIPID COMPOUNDS AND USES THEREOF Vascular Biogenics Ltd. (IL) 2011-08-03 EP disclosed
WO-2010052718-A9 OXIDIZED LIPID COMPOUNDS AND USES THEREOF VASCULAR BIOGENICS LTD. (IL) 2011-06-16 WO disclosed
WO-2010052718-A1 OXIDIZED LIPID COMPOUNDS AND USES THEREOF VASCULAR BIOGENICS LTD. (IL) 2010-05-14 WO disclosed
US-7488748-B2 3,6-Disubstituted azabicyclo hexane derivatives as muscarinic receptor antagonists RANBAXY LABORATORIES LIMITED (IN) 2009-02-10 US disclosed
US-20060247225-A1 3,6-Disubstituted azabicyclo hexane derivatives as muscarinic receptor antagonists RANBAXY LABORATORIES LIMITED (IN) 2006-11-02 US disclosed
EP-1590325-A1 3,6-DISUBSTITUTED AZABICYCLO HEXANE DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES, LTD. (IN) 2005-11-02 EP disclosed
WO-2004067510-A1 3,6-DISUBSTITUTED AZABICYCLO HEXANE DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2004-08-12 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 (4 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-20160256567-A1 COMPOSITIONS AND METHODS FOR DELIVERING MESSENGER RNA NSUN3, RNMT, RNASE1 EPHX2 2335/4885ALDH1A1 4469/4885CYP19A1 3651/4885
US-20060247225-A1 3,6-Disubstituted azabicyclo hexane derivatives as muscarinic receptor antagonists CHRM3, CHRM5, CHRM2 EPHX2 406/4885ALDH1A1 1292/4885CYP19A1 1534/4885
US-20130203707-A1 Oxidized Lipid Compounds and Uses Thereof LPO, GPX4, ALOX15B EPHX2 380/4885ALDH1A1 616/4885CYP19A1 797/4885
US-20110207703-A1 OXIDIZED LIPID COMPOUNDS AND USES THEREOF LPO, GPX4, ALOX15B EPHX2 380/4885ALDH1A1 616/4885CYP19A1 797/4885

“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.