SCHEMBL9814035

SCHEMBL9814035

CN(C=O)CCN(C)C=O

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.47
USP2 O75604 1/20 0.46
ALOX15 P16050 1/20 0.46

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
SCHEMBL616499 0.90
SCHEMBL11272869 0.90 CA12 (0.42) TSHRUSP2ALOX15
SCHEMBL41853 0.83
SCHEMBL13186697 0.83 USP2 (0.36) TSHRUSP2ALOX15
SCHEMBL1307259 0.83 USP2 (0.36) TSHRUSP2ALOX15
SCHEMBL1004994 0.81
SCHEMBL17333534 0.81
SCHEMBL209488 0.81
SCHEMBL442903 0.81
SCHEMBL17333386 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112830449-B Reversible liquid organic hydrogen storage method based on manganese catalytic hydrogenation and dehydrogenation reaction 清华大学 2022-09-27 CN claimed
EP-3489663-B1 HIGHLY SELECTIVE AND SENSITIVE DETECTION OF 2,4,6-TRINITROTOLUENE USING FLUORESCENCE ENHANCEMENT BY MEANS OF UV-INDUCED PHOTOREACTION WITH ANIONS BUNDESREPUBLIK DEUTSCHLAND VERTRETEN DURCH DIE BUNDESMINISTERIN FUER WIRTSCH UND ENERGIE DIESE VERTR (DE) 2022-04-27 EP claimed
US-10976256-B2 Highly selective and sensitive detection of 2,4,6-trinitrotoluene by means of fluorescence enhancement using UV-induced photoreaction with anions Bundesrepublik Deutschland, Vertreten Durch Den Bundesrepublik Für Wirtschaft Und Energie (DE) 2021-04-13 US claimed
EP-3489663-A1 HIGHLY SELECTIVE AND SENSITIVE DETECTION OF 2,4,6-TRINITROTOLUENE USING FLUORESCENCE ENHANCEMENT BY MEANS OF UV-INDUCED PHOTOREACTION WITH ANIONS Bundesrepublik Deutschland, Vertreten Durch Die Bundesministerin für Wirtschaft und Energie, Diese vertreten durch den Präsidenten der (DE) 2019-05-29 EP claimed
US-20190154581-A1 Highly Selective and Sensitive Detection of 2,4,6-Trinitrotoluene by Means of Fluorescence Enhancement Using UV-Induced Photoreaction with Anions Bundesrepublik Deutschland, Vertreten Durch Den Bundesrepublik Für Wirtschaft Und Energie (DE) 2019-05-23 US claimed
EP-0230224-B1 PROCESS FOR THE PREPARATION OF ALCOXYCARBONYL ISOCYANATES BAYER AG (DE) 1991-07-17 EP claimed
US-4777283-A Process for the preparation of alkoxycarbonyl isocyanates BAYER AKTIENGESELLSCHAFT (DE) 1988-10-11 US claimed
EP-0230224-A2 Process for the preparation of alcoxycarbonyl isocyanates BAYER AG (DE) 1987-07-29 EP claimed
CN-112830449-B Reversible liquid organic hydrogen storage method based on manganese catalytic hydrogenation and dehydrogenation reaction 清华大学 2022-09-27 CN disclosed
CN-112830449-B Reversible liquid organic hydrogen storage method based on manganese catalytic hydrogenation and dehydrogenation reaction 清华大学 2022-09-27 CN disclosed
EP-3489663-B1 HIGHLY SELECTIVE AND SENSITIVE DETECTION OF 2,4,6-TRINITROTOLUENE USING FLUORESCENCE ENHANCEMENT BY MEANS OF UV-INDUCED PHOTOREACTION WITH ANIONS BUNDESREPUBLIK DEUTSCHLAND VERTRETEN DURCH DIE BUNDESMINISTERIN FUER WIRTSCH UND ENERGIE DIESE VERTR (DE) 2022-04-27 EP disclosed
CN-112830449-A Reversible liquid organic hydrogen storage method based on manganese catalytic hydrogenation and dehydrogenation reaction 清华大学 2021-05-25 CN disclosed
US-10976256-B2 Highly selective and sensitive detection of 2,4,6-trinitrotoluene by means of fluorescence enhancement using UV-induced photoreaction with anions Bundesrepublik Deutschland, Vertreten Durch Den Bundesrepublik Für Wirtschaft Und Energie (DE) 2021-04-13 US disclosed
EP-3489663-A1 HIGHLY SELECTIVE AND SENSITIVE DETECTION OF 2,4,6-TRINITROTOLUENE USING FLUORESCENCE ENHANCEMENT BY MEANS OF UV-INDUCED PHOTOREACTION WITH ANIONS Bundesrepublik Deutschland, Vertreten Durch Die Bundesministerin für Wirtschaft und Energie, Diese vertreten durch den Präsidenten der (DE) 2019-05-29 EP disclosed
US-20110027202-A1 FLUID OIL-IN-WATER SUNSCREEN EMULSIONS CONTAINING GEMINI SURFACTANTS AND A CROSSLINKED COPOLYMER OF METHACRYLIC ACID AND OF C1-C4 ALKYL ACRYLATE L'OREAL (FR) 2011-02-03 US disclosed
US-20080207767-A1 Foamable Alcoholic Composition SILVER POINT FINANCE, LLC, AS COLLATERAL AGENT 2008-08-28 US disclosed
EP-0230224-B1 PROCESS FOR THE PREPARATION OF ALCOXYCARBONYL ISOCYANATES BAYER AG (DE) 1991-07-17 EP disclosed
US-4777283-A Process for the preparation of alkoxycarbonyl isocyanates BAYER AKTIENGESELLSCHAFT (DE) 1988-10-11 US disclosed
EP-0230224-A2 Process for the preparation of alcoxycarbonyl isocyanates BAYER AG (DE) 1987-07-29 EP disclosed
US-4042621-A METAL HALIDE CATALYST E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-08-16 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-20110027202-A1 FLUID OIL-IN-WATER SUNSCREEN EMULSIONS CONTAINING GEMINI SURFACTANTS AND A CROSSLINKED COPOLYMER OF METHACRYLIC ACID AND OF C1-C4 ALKYL ACRYLATE C1S, TP53, CDC25C TSHR 3269/4885USP2 2185/4885ALOX15 836/4885
US-20080207767-A1 Foamable Alcoholic Composition GEMIN4, PEX3, GEMIN5 TSHR 2917/4885USP2 3320/4885ALOX15 1947/4885

“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.