⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3861975 | 0.96 | — | — | |
| SCHEMBL12922020 | 0.78 | — | — | |
| SCHEMBL5769531 | 0.75 | — | — | |
| SCHEMBL2571537 | 0.75 | — | — | |
| SCHEMBL7261786 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL28636041 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL14738714 | 0.70 | — | — | |
| Nornitrogen Mustard SCHEMBL24674 | 0.67 | — | — | |
| SCHEMBL8514969 | 0.67 | — | — | |
| SCHEMBL11983269 | 0.67 | — | — |
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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101024681-A | Method for preparing fluorine-contained multi-function epoxy resin | UNIV DONGHUA (CN) | 2007-08-29 | — | — | CN | claimed |
| US-5004808-A | Aminoalkyl-derivatives of hydroxyalkyl-celluloses | DOMTAR INC. | 1991-04-02 | — | — | US | claimed |
| US-20240018119-A1 | CARBOXAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING MENTAL ILLNESS | TRINEURO (KR) | 2024-01-18 | — | — | US | disclosed |
| CN-113135869-B | Method for preparing alpha-aryl carbonyl compound and product | 浙江师范大学 | 2022-06-10 | — | — | CN | disclosed |
| CN-113135869-A | Method for preparing alpha-aryl carbonyl compound and product | 浙江师范大学 | 2021-07-20 | — | — | CN | disclosed |
| US-9809604-B2 | DGAT1 inhibitor and preparation method and use thereof | QINGDAO HUANGHAI PHARMACEUTICAL CO., LTD. (CN) | 2017-11-07 | — | — | US | disclosed |
| EP-2423201-B1 | Luminescent macrocyclic lanthanide complexes | UNIV CALIFORNIA (US) | 2017-10-04 | — | — | EP | disclosed |
| US-9708303-B2 | LFA-1 inhibitor and methods of preparation and polymorph thereof | SARCODE BIOSCIENCE INC. (US) | 2017-07-18 | — | — | US | disclosed |
| US-9580383-B2 | Compositions and methods for the treatment of multiple sclerosis | CELLIX BIO PRIVATE LIMITED (IN) | 2017-02-28 | — | — | US | disclosed |
| US-20170029410-A1 | CRYSTALLINE PHARMACEUTICAL AND METHODS OF PREPARATION AND USE THEREOF | SARCODE BIOSCIENCE INC. (US) | 2017-02-02 | — | — | US | disclosed |
| US-20160368902-A1 | CRYSTALLINE PHARMACEUTICAL AND METHODS OF PREPARATION AND USE THEREOF | SARCODE BIOSCIENCE INC. (US) | 2016-12-22 | — | — | US | disclosed |
| US-8080562-B2 | Crystalline pharmaceutical and methods of preparation and use thereof | SARCODE BIOSCIENCE INC. (US) | 2011-12-20 | — | — | US | disclosed |
| WO-2010142507-A2 | ADHESIVE COMPOSITION | KITOZYME S.A. (BE) | 2010-12-16 | — | — | WO | disclosed |
| US-20100035870-A1 | Pyrimidin-4-yl-3, 4-Dihydro-2H-Pyrrolo[1,2A] Pyrazin-1-one Compounds | CYCLACEL LIMITED (GB) | 2010-02-11 | — | — | US | disclosed |
| US-20090298869-A1 | Crystalline pharmaceutical and methods of preparation and use thereof | CITIBANK, N.A., AS NOTES COLLATERAL AGENT | 2009-12-03 | — | — | US | disclosed |
| US-20080234237-A1 | QUINOLONE AND TETRAHYDROQUINOLONE AND RELATED COMPOUNDS HAVING NOS INHIBITORY ACTIVITY | NEURAXON, INC. (CA) | 2008-09-25 | — | — | US | disclosed |
| US-20070232577-A1 | Synthetic pentacyclic triterpenoids and derivatives of betulinic acid and betulin | ADVANCED LIFE SCIENCES, INC. (US) | 2007-10-04 | — | — | US | disclosed |
| CN-101024681-A | Method for preparing fluorine-contained multi-function epoxy resin | UNIV DONGHUA (CN) | 2007-08-29 | — | — | CN | disclosed |
| US-5427777-A | Phosphonium salt with sites effective for binding bile acid anions linked to crosslinked non-digestible polymer backbone | LOWCHOL SCIENTIFIC, INC. (CA) | 1995-06-27 | — | — | US | disclosed |
| US-5189111-A | AMINOALKYLATED SIDE-CHAINS-CONTAINING VINYLIC COPOLYMERS | SANDOZ LTD. (CH) | 1993-02-23 | — | — | US | disclosed |