SCHEMBL717449

SCHEMBL717449

Clc1cccc(C#Cc2ccccc2)c1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.60
APP P05067 1/20 0.57
GRM5 P41594 4/20 0.55
PTGDR2 Q9Y5Y4 2/20 0.47
CYP2C9 P11712 1/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
TSHR P16473 1/20 0.46
PTGES O14684 2/20 0.44
HAO1 Q9UJM8 1/20 0.44
MAPT P10636 1/20 0.44
ALOX5 P09917 1/20 0.44
MAOB P27338 1/20 0.43
PTPN11 Q06124 1/20 0.43
CYP2D6 P10635 1/20 0.42

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
SCHEMBL30707869 0.93 KCNH2 (0.67) KCNH2APPGRM5PTGDR2CYP2C9
SCHEMBL4562631 0.93 KCNH2 (0.67) KCNH2APPGRM5PTGDR2CYP2C9
Charcoal, Activated SCHEMBL31286308 0.90 KCNH2 (0.64) KCNH2APPGRM5PTGDR2CYP2C9
SCHEMBL30081497 0.88 KCNH2 (0.58) KCNH2APPGRM5PTGDR2CYP2C9
SCHEMBL28630419 0.88 KCNH2 (0.58) KCNH2APPGRM5PTGDR2CYP2C9
Ammonia Solution, Strong SCHEMBL5555414 0.86 KCNH2 (0.56) KCNH2APPGRM5PTGDR2CYP2C9
SCHEMBL6364777 0.82 APP (0.75) KCNH2APPGRM5CYP2C9CA12
SCHEMBL25490062 0.81 KCNH2 (0.55) KCNH2GRM5PTGDR2CYP2C9TSHR
SCHEMBL718734 0.81 KCNH2 (0.55) KCNH2GRM5PTGDR2CYP2C9TSHR
SCHEMBL29978649 0.81 KCNH2 (0.55) KCNH2GRM5PTGDR2CYP2C9TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116410126-B Ligand, ruthenium complex, preparation method thereof and application of ligand and ruthenium complex in catalyzing alkyne semi-hydrogenation reaction 河北师范大学 2025-05-09 CN disclosed
CN-116410126-A Ligand, ruthenium complex, preparation method thereof and application of ligand and ruthenium complex in catalyzing alkyne semi-hydrogenation reaction 河北师范大学 2023-07-11 CN disclosed
EP-3634950-B1 COBALT COMPLEXES, PROCESS FOR PREPARATION AND USE THEREOF COUNCIL SCIENT IND RES (IN) 2022-03-09 EP disclosed
US-11040994-B2 Cobalt complexes, process for preparation and use thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2021-06-22 US disclosed
US-20200223880-A1 COBALT COMPLEXES, PROCESS FOR PREPARATION AND USE THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2020-07-16 US disclosed
US-8445141-B2 Sulfonic acid group-containing polymer, method for producing the same, resin composition containing such sulfonic acid group-containing polymer, polymer electrolyte membrane, polymer electrolyte membrane/electrode assembly, and fuel cell TOYO BOSEKI KABUSHIKI KAISHA (JP) 2013-05-21 US disclosed
US-8216727-B2 Aromatic hydrocarbon based proton exchange membrane and direct methanol fuel cell using same TOYO BOSEKI KABUSHIKI KAISHA (JP) 2012-07-10 US disclosed
US-20120052411-A9 AROMATIC HYDROCARBON BASED PROTON EXCHANGE MEMBRANE AND DIRECT METHANOL FUEL CELL USING SAME TOYO BOSEKI KABUSHIKI KAISHA (JP) 2012-03-01 US disclosed
EP-1457511-B1 CROSSLINKABLE AROMATIC RESINS HAVING PROTONIC ACID GROUPS AND ION CONDUCTIVE POLYMER MEMBRANES BINDERS AND FUEL CELLS MADE BY USING THE SAME MITSUI CHEMICALS INC (JP) 2009-07-15 EP disclosed
US-20090075147-A1 Sulfonic acid group-containing polymer, method for producing the same, resin composition containing such sulfonic acid group-containing polymer, polymer electrolyte membrane, polymer electrolyte membrane/electrode assembly, and fuel cell TOYO BOSEKI KABUSHIKI KAISHA (JP) 2009-03-19 US disclosed
US-7345135-B2 Crosslinkable aromatic resin having protonic acid group, and ion conductive polymer membrane, binder and fuel cell using the resin MITSUI CHEMICALS, INC. (JP) 2008-03-18 US disclosed
EP-1889863-A1 SULFONIC ACID GROUP-CONTAINING POLYMER, METHOD FOR PRODUCING SAME, RESIN COMPOSITION CONTAINING SUCH SULFONIC ACID GROUP-CONTAINING POLYMER, POLYMER ELECTROLYTE MEMBRANE, POLYMER ELECTROLYTE MEMBRANE/ELECTRODE ASSEMBLY, AND FUEL CELL Toyo Boseki Kabushiki Kasisha (JP) 2008-02-20 EP disclosed
US-20070207361-A1 AROMATIC HYDROCARBON BASED PROTON EXCHANGE MEMBRANE AND DIRECT METHANOL FUEL CELL USING SAME TOYO BOSEKI KABUSHIKI KAISHA (JP) 2007-09-06 US disclosed
EP-1826846-A1 AROMATIC HYDROCARBON-BASE PROTON EXCHANGE MEMBRANE AND DIRECT METHANOL FUEL CELL USING SAME Toyo Boseki Kabushiki Kasisha (JP) 2007-08-29 EP disclosed
CN-1608065-A Phenyl substituted triazoles and their use as selective inhibors of akl5 kinase and pharmaceutical compositions containing the compounds SMITHKLINE BEECHAM CORP (US) 2005-04-20 CN disclosed
US-20040191602-A1 Crosslinkable aromatic resin having protonic acid group, and ion conductive polymer membrane, binder and fuel cell using the resin MITSUI CHEMICALS, INC. (JP) 2004-09-30 US disclosed
EP-1457511-A1 CROSSLINKABLE AROMATIC RESINS HAVING PROTONIC ACID GROUPS AND ION CONDUCTIVE POLYMER MEMBRANES BINDERS AND FUEL CELLS MADE BY USING THE SAME Mitsui Chemicals, Inc. (JP) 2004-09-15 EP disclosed
US-6020519-A Diphenyl-cyclopropenes as selective K-agonists WARNER-LAMBERT COMPANY (US) 2000-02-01 US disclosed
US-5968968-A Diphenyl-cyclopropenes as selective K-agonists WARNER-LAMBERT COMPANY (US) 1999-10-19 US disclosed
WO-1998003491-A1 DIPHENYL-CYCLOPROPENES AS SELECTIVE K-AGONISTS WARNER-LAMBERT COMPANY (US) 1998-01-29 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 (2 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-20200223880-A1 COBALT COMPLEXES, PROCESS FOR PREPARATION AND USE THEREOF MAPT, PSEN1, PSEN2 KCNH2 2841/4885APP 5/4885GRM5 1926/4885
US-11040994-B2 Cobalt complexes, process for preparation and use thereof MAPT, PSEN1, PSEN2 KCNH2 2841/4885APP 5/4885GRM5 1926/4885

“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.