⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL29598265 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL928401 | 0.98 | ENPP2 (0.95) | — | |
| Bromide SCHEMBL920224 | 0.98 | ENPP2 (0.95) | — | |
| Hydrochloric Acid SCHEMBL3564737 | 0.95 | ENPP2 (0.91) | — | |
| Hydrochloric Acid SCHEMBL18641325 | 0.89 | ENPP2 (0.80) | — | |
| Acetic Acid SCHEMBL4083695 | 0.88 | ENPP2 (0.77) | — | |
| SCHEMBL2948809 | 0.87 | ENPP2 (0.76) | — | |
| Benzylamine SCHEMBL5930798 | 0.82 | LOXL2 (0.74) | — | |
| SCHEMBL27575536 | 0.82 | ENPP2 (0.68) | — | |
| SCHEMBL29465557 | 0.81 | TAAR1 (1.00) | — |
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 972 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118929620-A | Preparation method of phenolic resin-based hard carbon nanospheres with adjustable particle size and carbon structure | 北京化工大学 | 2024-11-12 | — | — | CN | claimed |
| CN-115228290-A | Preparation method of cleaning-resistant reverse osmosis membrane | 万华化学集团股份有限公司 | 2022-10-25 | — | — | CN | claimed |
| US-20220112156-A1 | ADAMANTANECARBOXYLIC ACID BENZYL AMIDE DERIVATIVE COMPOUND AND SKIN WHITENING COMPOSITION COMPRISING SAME | AMOREPACIFIC CORPORATION (KR) | 2022-04-14 | — | — | US | claimed |
| CN-113286779-A | Adamantane carboxylic acid benzylamide derivative compound and skin whitening composition containing same | 株式会社爱茉莉太平洋 | 2021-08-20 | — | — | CN | claimed |
| CN-113046734-A | Bivalent palladium complex solution and preparation method and application thereof | 上海天承化学有限公司 | 2021-06-29 | — | — | CN | claimed |
| WO-2020141927-A1 | ADAMANTANECARBOXYLIC ACID BENZYL AMIDE DERIVATIVE COMPOUND AND SKIN WHITENING COMPOSITION COMPRISING SAME | ㈜아모레퍼시픽 | 2020-07-09 | — | — | WO | claimed |
| EP-3394027-B1 | METHOD FOR PREPARING PHENOLICS USING A CATALYST | TNO (NL) | 2020-02-19 | — | — | EP | claimed |
| US-10407376-B2 | Method to prepare phenolics from biomass | NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) | 2019-09-10 | — | — | US | claimed |
| US-10364203-B2 | Method for preparing phenolics using a catalyst | NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) | 2019-07-30 | — | — | US | claimed |
| CN-109312476-A | Deoxidant for boiler and deoxidization method for boiler water system | 栗田工业株式会社 | 2019-02-05 | — | — | CN | claimed |
| WO-2000047578-A1 | HETEROARYL AMIDINES, METHYLAMIDINES AND GUANIDINES AS PROTEASE INHIBITORS | 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) | 2000-08-17 | — | — | WO | claimed |
| WO-2000044750-A1 | PURINE INHIBITORS OF CYCLIN DEPENDENT KINASE 2 AND Iλ-A$g(a) | CV THERAPEUTICS, INC. (US) | 2000-08-03 | — | — | WO | claimed |
| EP-1021186-A4 | PURINE INHIBITORS OF CYCLIN DEPENDENT KINASE 2 AND IkappaB-alpha | CV THERAPEUTICS INC (US) | 2000-07-26 | — | — | EP | claimed |
| EP-1021186-A1 | PURINE INHIBITORS OF CYCLIN DEPENDENT KINASE 2 AND IkappaB-alpha | CV THERAPEUTICS, INC. (US) | 2000-07-26 | — | — | EP | claimed |
| EP-0998946-A1 | Non-porphyrin compound for use as a diagnosticum and/or pharmaceutical | K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) | 2000-05-10 | — | — | EP | claimed |
| WO-2000009169-A1 | NON-PORPHYRIN COMPOUND FOR USE AS A DIAGNOSTICUM AND/OR PHARMACEUTICAL | K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) | 2000-02-24 | — | — | WO | claimed |
| EP-0874847-A1 | NOVEL PURINE DERIVATIVES HAVING, IN PARTICULAR, ANTIPROLIFERATIVE PROPERTIES, AND BIOLOGICAL USES THEREOF | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 1998-11-04 | — | — | EP | claimed |
| WO-1998005335-A9 | PURINE INHIBITORS OF CYCLIN DEPENDENT KINASE 2 AND IλB-$g(a) | — | 1998-05-28 | — | — | WO | claimed |
| WO-1998005335-A1 | PURINE INHIBITORS OF CYCLIN DEPENDENT KINASE 2 AND IλB-$g(a) | CV THERAPEUTICS, INC. (US) | 1998-02-12 | — | — | WO | claimed |
| WO-1997020842-A1 | NOVEL PURINE DERIVATIVES HAVING, IN PARTICULAR, ANTIPROLIFERATIVE PROPERTIES, AND BIOLOGICAL USES THEREOF | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) | 1997-06-12 | — | — | WO | claimed |