SCHEMBL1130174

SCHEMBL1130174

O=C=NC1CCC(CC2CCC(N=C=O)CC2N=C=O)CC1

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL840992 0.90 ALDH1A1 (0.46) ALDH1A1
SCHEMBL1052082 0.89 ALDH1A1 (0.40) ALDH1A1
SCHEMBL26017 0.83 ALDH1A1 (0.48) ALDH1A1
SCHEMBL2350002 0.83 ALDH1A1 (0.48) ALDH1A1
SCHEMBL2874497 0.81 ALDH1A1 (0.38) ALDH1A1
SCHEMBL374623 0.81 ALDH1A1 (0.42) ALDH1A1
SCHEMBL23743495 0.79 ALDH1A1 (0.54) ALDH1A1
SCHEMBL5903114 0.79 ALDH1A1 (0.54) ALDH1A1
SCHEMBL6318341 0.79 ALDH1A1 (0.54) ALDH1A1
SCHEMBL8733246 0.79 ALDH1A1 (0.54) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210249689-A1 SILICON-BASED ENERGY STORAGE DEVICES WITH ELECTROLYTE CONTAINING CYANATE BASED COMPOUNDS ENEVATE CORPORATION 2021-08-12 US disclosed
US-10308775-B2 Fiber-reinforced resin composition, and fiber-reinforced composite material TORAY INDUSTRIES INC. (JP) 2019-06-04 US disclosed
EP-3064551-B1 FIBER-REINFORCED RESIN COMPOSITION, AND FIBER-REINFORCED COMPOSITE MATERIAL TORAY INDUSTRIES (JP) 2018-07-25 EP disclosed
US-10017613-B2 Method of producing carbon fiber-reinforced polyarylene sulfide TORAY INDUSTRIES, INC. (JP) 2018-07-10 US disclosed
EP-3064535-B1 METHOD FOR PRODUCING POLYARYLENE SULFIDE REINFORCED WITH CARBON FIBERS TORAY INDUSTRIES (JP) 2018-03-21 EP disclosed
US-20160264740-A1 FIBER-REINFORCED RESIN COMPOSITION, AND FIBER-REINFORCED COMPOSITE MATERIAL TORAY INDUSTRIES, INC. (JP) 2016-09-15 US disclosed
US-20160257793-A1 METHOD OF PRODUCING CARBON FIBER-REINFORCED POLYARYLENE SULFIDE TORAY INDUSTRIES, INC. (JP) 2016-09-08 US disclosed
EP-3064551-A1 FIBER-REINFORCED RESIN COMPOSITION, AND FIBER-REINFORCED COMPOSITE MATERIAL Toray Industries, Inc. (JP) 2016-09-07 EP disclosed
EP-3064535-A1 METHOD FOR PRODUCING POLYARYLENE SULFIDE REINFORCED WITH CARBON FIBERS Toray Industries, Inc. (JP) 2016-09-07 EP disclosed
US-8449794-B2 Non-resonant two-photon absorption recording material and non-resonant two-photon absorption compound FUJIFILM CORPORATION (JP) 2013-05-28 US disclosed
US-6042910-A A POLYARYLENE SULFIDE RESIN COMPOSITION COMPRISING 70-99.9% OF A POLYARYLENE SULFIDE RESIN AND 30-0.1% OF AN ALIPHATIC OR SATURATED CYCLIC POLYCARBODIIMIDE; ADHESION TO ADHESIVES SUCH AS EPOXY RESIN; ELECTRONIC CONTAINERS; SEALED CONDUCTORS IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2000-03-28 US disclosed
US-5958648-A Radiation sensitive resin composition JSR CORPORATION (JP) 1999-09-28 US disclosed
EP-0880075-A1 Radiation sensitive resin composition JSR Corporation (JP) 1998-11-25 EP disclosed
US-5576398-A POLYCARBODIIMIDES GRAFTED WITH CARBOXYLIC ANHYDRIDE AND EPOXY COMPOUND FOR MOLDING MATERIALS JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1996-11-19 US disclosed
EP-0162347-B1 CYCLOALIPHATIC TRIISOCYANATES, PROCESS FOR THEIR PRODUCTION, AND THEIR USE IN THE MANUFACTURE OF POLYURETHANES BAYER AG (DE) 1987-12-09 EP disclosed
US-4675437-A Cycloaliphatic triisocyanates BAYER AKTIENGESELLSCHAFT (DE) 1987-06-23 US disclosed
EP-0109932-B1 PROCESS FOR THE PREPARATION OF OLIGOMERIC POLYESTER AMIDES CONTAINING STERICALLY HINDERED AMINO MOIETIES CIBA-GEIGY AG (CH) 1986-09-03 EP disclosed
EP-0162346-A1 Triisocyanates, process for their production, and their use in the manufacture of polyurethanes BAYER AG (DE) 1985-11-27 EP disclosed
EP-0162347-A1 Cycloaliphatic triisocyanates, process for their production, and their use in the manufacture of polyurethanes BAYER AG (DE) 1985-11-27 EP disclosed
US-4086211-A Method of producing polyurethane products having an improved flex crack resistance BRIDGESTONE TIRE COMPANY LIMITED (JA) 1978-04-25 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 (1 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-20210249689-A1 SILICON-BASED ENERGY STORAGE DEVICES WITH ELECTROLYTE CONTAINING CYANATE BASED COMPOUNDS SIRT3, SLC6A12, HCN2 ALDH1A1 1987/4885

“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.