SCHEMBL6689193

SCHEMBL6689193

O=C(Oc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O)c1cc(O)c(O)c(O)c1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 5/20 0.84
▸ CYP3A4 P08684 5/20 0.65
▸ CYP2D6 P10635 5/20 0.65
▸ POLH Q9Y253 5/20 0.65
▸ KDM4E B2RXH2 4/20 0.65
▸ POLB P06746 3/20 0.65
▸ APEX1 P27695 3/20 0.65
▸ RECQL P46063 3/20 0.65
▸ MCL1 Q07820 1/20 0.65
▸ ABCB1 P08183 6/20 0.62
▸ MEN1 O00255 4/20 0.62
▸ MAPT P10636 4/20 0.62
▸ KMT2A Q03164 4/20 0.62
▸ CYP1A1 P04798 4/20 0.62
▸ CYP1A2 P05177 4/20 0.62
▸ CYP1B1 Q16678 4/20 0.62
▸ FTO Q9C0B1 4/20 0.62
▸ HSD17B10 Q99714 3/20 0.62
▸ BCHE P06276 3/20 0.62
▸ CYP2C9 P11712 3/20 0.62

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
SCHEMBL6685824 0.92 EPHX2 (0.85) EPHX2CYP3A4CYP2D6POLHKDM4E
SCHEMBL6072546 0.91 EPHX2 (1.00) EPHX2CYP3A4CYP2D6POLHKDM4E
SCHEMBL3777085 0.91 EPHX2 (0.80) EPHX2CYP3A4CYP2D6POLHKDM4E
SCHEMBL10307570 0.91 EPHX2 (0.76) EPHX2CYP3A4CYP2D6POLHKDM4E
SCHEMBL10307571 0.87 EPHX2 (0.76) EPHX2CYP3A4CYP2D6POLHKDM4E
SCHEMBL23441996 0.85 EPHX2 (0.82) EPHX2CYP3A4CYP2D6POLHKDM4E
SCHEMBL23442030 0.84 EPHX2 (0.88) EPHX2CYP3A4CYP2D6POLHKDM4E
SCHEMBL23442126 0.84 EPHX2 (0.88) EPHX2CYP3A4CYP2D6POLHKDM4E
SCHEMBL15452189 0.84 EPHX2 (0.70) EPHX2CYP3A4CYP2D6POLHKDM4E
SCHEMBL30627917 0.83 CYP3A4 (0.75) EPHX2CYP3A4CYP2D6POLHKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004084886-A1 THE USE OF BLOCKERS FOR THE LONG-TERM INHIBITION OF Na+-K+-ATPase AND/OR Na+/H+ EXCHANGE ACTIVITIES FOR THE PREPARATION OF A MEDICAMENT FOR THE INTESTINAL THERAPY UNIVERSIDADE DO PORTO (PT) 2004-10-07 — — WO claimed
EP-3763419-A1 CHEMOSENSORY RECEPTOR LIGAND-BASED THERAPIES Anji Pharma (US) LLC (US) 2021-01-13 — — EP disclosed
EP-2661266-B1 CHEMOSENSORY RECEPTOR LIGAND-BASED THERAPIES ANJI PHARMA (US) LLC (US) 2020-09-16 — — EP disclosed
US-9962344-B2 Chemosensory receptor ligand-based therapies ELCELYX THERAPEUTICS, INC. (US) 2018-05-08 — — US disclosed
US-9962344-B2 Chemosensory receptor ligand-based therapies ELCELYX THERAPEUTICS, INC. (US) 2018-05-08 — — US disclosed
US-20170020829-A1 Chemosensory Receptor Ligand-Based Therapies ANJI PHARMACEUTICALS INC. 2017-01-26 — — US disclosed
US-20170020829-A1 Chemosensory Receptor Ligand-Based Therapies ANJI PHARMACEUTICALS INC. 2017-01-26 — — US disclosed
US-9463170-B2 Chemosensory receptor ligand-based therapies ELCELYX THERAPEUTICS, INC. (US) 2016-10-11 — — US disclosed
US-9463170-B2 Chemosensory receptor ligand-based therapies ELCELYX THERAPEUTICS, INC. (US) 2016-10-11 — — US disclosed
US-20150265555-A1 Chemosensory Receptor Ligand-Based Therapies ANJI PHARMACEUTICALS INC. 2015-09-24 — — US disclosed
US-20150265555-A1 Chemosensory Receptor Ligand-Based Therapies ANJI PHARMACEUTICALS INC. 2015-09-24 — — US disclosed
US-9050292-B2 Chemosensory receptor ligand-based therapies ELCELYX THERAPEUTICS, INC. (US) 2015-06-09 — — US disclosed
US-9050292-B2 Chemosensory receptor ligand-based therapies ELCELYX THERAPEUTICS, INC. (US) 2015-06-09 — — US disclosed
US-20140030332-A1 Chemosensory Receptor Ligand-Based Therapies ELCELYX THERAPEUTICS, INC. (US) 2014-01-30 — — US disclosed
US-20140030332-A1 Chemosensory Receptor Ligand-Based Therapies ELCELYX THERAPEUTICS, INC. (US) 2014-01-30 — — US disclosed
US-20120177730-A1 Chemosensory Receptor Ligand-Based Therapies ELCELYX THERAPEUTICS, INC. (US) 2012-07-12 — — US disclosed
US-20120177730-A1 Chemosensory Receptor Ligand-Based Therapies ELCELYX THERAPEUTICS, INC. (US) 2012-07-12 — — US disclosed
WO-2004084886-A1 THE USE OF BLOCKERS FOR THE LONG-TERM INHIBITION OF Na+-K+-ATPase AND/OR Na+/H+ EXCHANGE ACTIVITIES FOR THE PREPARATION OF A MEDICAMENT FOR THE INTESTINAL THERAPY UNIVERSIDADE DO PORTO (PT) 2004-10-07 — — 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-20120177730-A1 Chemosensory Receptor Ligand-Based Therapies TAS1R2, TAS2R1, GPR119 EPHX2 3913/4885CYP3A4 3294/4885CYP2D6 3823/4885
US-20150265555-A1 Chemosensory Receptor Ligand-Based Therapies TAS1R2, TAS2R1, GPR119 EPHX2 3913/4885CYP3A4 3294/4885CYP2D6 3823/4885
US-20170020829-A1 Chemosensory Receptor Ligand-Based Therapies TAS1R2, TAS2R1, GPR119 EPHX2 3913/4885CYP3A4 3294/4885CYP2D6 3823/4885
US-20140030332-A1 Chemosensory Receptor Ligand-Based Therapies TAS1R2, TAS2R1, GPR119 EPHX2 3913/4885CYP3A4 3294/4885CYP2D6 3823/4885

“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.

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