SCHEMBL518737

SCHEMBL518737

c1ccc(P(c2ccccc2)P(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.60
CYP3A4 P08684 1/20 0.60
ESR1 P03372 4/20 0.43
ESR2 Q92731 4/20 0.43
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
TSHR P16473 4/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
ALOX12 P18054 2/20 0.35
CA12 O43570 1/20 0.35
GLA P06280 1/20 0.35
CA3 P07451 1/20 0.35
CA4 P22748 1/20 0.35
CA14 Q9ULX7 1/20 0.35
LMNA P02545 1/20 0.35
ACHE P22303 1/20 0.35
CA7 P43166 1/20 0.35

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
Ethane SCHEMBL10788468 0.93 TDP1 (0.53) TDP1CYP3A4ESR1ESR2ALDH1A1
Sulfurous Acid SCHEMBL10280435 0.82 TDP1 (0.43) TDP1CYP3A4ESR1ESR2ALDH1A1
Sulfurous Acid SCHEMBL2310714 0.82 TDP1 (0.43) TDP1CYP3A4ESR1ESR2ALDH1A1
SCHEMBL13876658 0.79 TDP1 (0.47) TDP1CYP3A4ESR1ESR2ALDH1A1
Hydrochloric Acid SCHEMBL11863752 0.77 TDP1 (0.86) TDP1CYP3A4ESR1ESR2ALDH1A1
SCHEMBL4423530 0.77 CYP3A4 (0.45) TDP1CYP3A4ESR1ESR2ALDH1A1
SCHEMBL5028587 0.75 TDP1 (1.00) TDP1CYP3A4ESR1ESR2ALDH1A1
SCHEMBL2085135 0.75 TDP1 (1.00) TDP1CYP3A4ESR1ESR2ALDH1A1
Benzene SCHEMBL6890099 0.75 TDP1 (1.00) TDP1CYP3A4ESR1ESR2ALDH1A1
SCHEMBL101 0.75 TDP1 (1.00) TDP1CYP3A4ESR1ESR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3130024-B1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, POLYMER ELECTROLYTE MEMBRANE WITH CATALYST LAYER, MEMBRANE ELECTRODE ASSEMBLY, AND POLYMER ELECTROLYTE FUEL CELL EACH USING THE SAME TORAY INDUSTRIES (JP) 2020-02-19 EP claimed
US-10186725-B2 Polymer electrolyte composition and polymer electrolyte membrane, polymer electrolyte membrane with catalyst layer, membrane electrode assembly, and polymer electrolyte fuel cell each using the same TORAY INDUSTRIES, INC. (JP) 2019-01-22 US claimed
EP-3130024-A1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, POLYMER ELECTROLYTE MEMBRANE WITH CATALYST LAYER, MEMBRANE ELECTRODE ASSEMBLY, AND POLYMER ELECTROLYTE FUEL CELL EACH USING THE SAME Toray Industries, Inc. (JP) 2017-02-15 EP claimed
US-20170033387-A1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, POLYMER ELECTROLYTE MEMBRANE WITH CATALYST LAYER, MEMBRANE ELECTRODE ASSEMBLY, AND POLYMER ELECTROLYTE FUEL CELL EACH USING THE SAME CELLCENTRIC GMBH & CO. KG (DE) 2017-02-02 US claimed
WO-2015155979-A1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, POLYMER ELECTROLYTE MEMBRANE WITH CATALYST LAYER, MEMBRANE ELECTRODE ASSEMBLY, AND POLYMER ELECTROLYTE FUEL CELL EACH USING THE SAME TORAY INDUSTRIES, INC. (JP) 2015-10-15 WO claimed
EP-2478044-B1 HALOGEN-FREE, FLAME-PROOF POLYMER FOAMS CONTAINING AT LEAST ONE OLIGOPHOSPHORUS COMPOUND BASF SE (DE) 2013-07-17 EP claimed
EP-1893654-B1 PREPARATION OF SOLUBLE AND COLLOIDAL MOLECULARLY IMPRINTED POLYMERS BY LIVING POLYMERIZATION UNIV CRANFIELD (GB) 2011-11-09 EP claimed
EP-1598053-B1 Use of a composition containing at least one phosphine as majority reducing agent to remove the artificial colour of keratinic fibres OREAL (FR) 2006-12-20 EP claimed
EP-1598053-A1 Use of a composition containing at least one phosphine as majority reducing agent to remove the artificial colour of keratinic fibres L'OREAL (FR) 2005-11-23 EP claimed
US-20050251928-A1 Method for stripping artificial color from keratin fibers L'OREAL (FR) 2005-11-17 US claimed
EP-0743574-B1 Migration imaging members XEROX CORP (US) 2000-12-27 EP claimed
EP-0743573-B1 Method for obtaining image contrast migration imaging members XEROX CORP (US) 2000-09-06 EP claimed
EP-0320761-B1 Use of phosphanes and/or diphosphanes in the preparation of polymers on an isocyanate basis BAYER AG (DE) 1997-03-26 EP claimed
EP-0743573-A2 Method for obtaining image contrast migration imaging members XEROX CORPORATION (US) 1996-11-20 EP claimed
EP-0743574-A2 Migration imaging members XEROX CORPORATION (US) 1996-11-20 EP claimed
US-5563014-A SOFTENABLE LAYER CONTAINIG PHOTOSENSITIVE MARKING MATERIAL; TRANSPARENTIZING AGENT XEROX CORPORATION (US) 1996-10-08 US claimed
US-5514505-A SELECTIVE TRANSPARENTIZATION OF PHOTOSENSITIVE MIGRATION MARKING PARTICLES EMBEDDED NEAR THE SURFACE OF A SOFTENABLE LAYER SUPPORTED BY AN ELECTROCONDUCTIVE SUBSTRATE XEROX CORPORATION (US) 1996-05-07 US claimed
EP-0320761-A2 Use of phosphanes and/or diphosphanes in the preparation of polymers on an isocyanate basis BAYER AG (DE) 1989-06-21 EP claimed
US-20250368598-A1 CATALYTIC CARBOXYCARBONYLATION OF ALKENES TO FORM ANHYDRIDES BHATTACHARYA SHRABANTI (US) 2025-12-04 US disclosed
US-4323698-A COORDINATION COMPOUNDS OF ION EXCHANGE RESINS MOBIL OIL CORPORATION (US) 1982-04-06 US 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-20250368598-A1 CATALYTIC CARBOXYCARBONYLATION OF ALKENES TO FORM ANHYDRIDES CA4, CA12, CA14 TDP1 3585/4885CYP3A4 841/4885ESR1 4010/4885
US-20050251928-A1 Method for stripping artificial color from keratin fibers KRT18, DSG1, JUP TDP1 3996/4885CYP3A4 4442/4885ESR1 3834/4885

“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.