Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Propane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ 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 | |
|---|---|---|---|---|
| Propane SCHEMBL8927329 | 0.83 | — | — | |
| Propane SCHEMBL28117240 | 0.83 | — | — | |
| Propane SCHEMBL21552058 | 0.83 | — | — | |
| Propane SCHEMBL27383381 | 0.83 | — | — | |
| Propane SCHEMBL27533963 | 0.83 | — | — | |
| Propane SCHEMBL28839569 | 0.83 | — | — | |
| Propane SCHEMBL10956924 | 0.82 | TSHR (0.43) | — | |
| Propane SCHEMBL1021 | 0.82 | — | — | |
| Propane SCHEMBL9246294 | 0.82 | — | — | |
| Propane SCHEMBL286506 | 0.82 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5770663-A | HOMO OR COPOLYMERIZING UNSATURATED MONOMER SELECTED FROM ALPHA-OLEFIN IN PRESENCE OF METALLOCENE CATALYST AND A ORGANOMETALLIC COMPOUND OF 1A, 2A AND 3B AS COCATALYST | PHILLIPS PETROLEUM COMPANY (US) | 1998-06-23 | — | — | US | claimed |
| CN-1068829-A | Organometallic fluorenyl compounds and preparation thereof and application | PHILLIPS PETROLEUM CO (US) | 1993-02-10 | — | — | CN | claimed |
| US-7247686-B2 | Solid cocatalyst component for olefin polymerization and catalyst system thereof | BASELL POLYOLEFINE GMBH (DE) | 2007-07-24 | — | — | US | disclosed |
| EP-1442067-B1 | SOLID COCATALYST COMPONENT FOR OLEFIN POLYMERIZATION AND CATALYST SYSTEM THEREOF | SUNALLOMER LTD (JP) | 2007-04-18 | — | — | EP | disclosed |
| CN-1289536-C | Oleifin polymerization catalyst, catalyst component for olefin polymerization, method of storing these, and process for producing olefin polymer | SUNALLOMER LTD (JP) | 2006-12-13 | — | — | CN | disclosed |
| CN-1612900-A | Solid cocatalyst component for olefin polymerization and catalyst system thereof | SUNALLOMER LTD (JP) | 2005-05-04 | — | — | CN | disclosed |
| US-20050009689-A1 | Solid cocatalyst component for olefin polymerization and catalyst system thereof | SUNALLOMER LTD. (JP) | 2005-01-13 | — | — | US | disclosed |
| EP-1442067-A1 | SOLID COCATALYST COMPONENT FOR OLEFIN POLYMERIZATION AND CATALYST SYSTEM THEREOF | Sunallomer Ltd (JP) | 2004-08-04 | — | — | EP | disclosed |
| CN-1481394-A | Olefin polymerization catalyst, olefin polymerization catalyst component and method for storing the same, and process for producing olefin polymer | 胜亚诺盟股份有限公司 | 2004-03-10 | — | — | CN | disclosed |
| WO-2003035708-A1 | SOLID COCATALYST COMPONENT FOR OLEFIN POLYMERIZATION AND CATALYST SYSTEM THEREOF | SUNALLOMER LTD (JP) | 2003-05-01 | — | — | WO | disclosed |
| US-6403734-B1 | POLYMERIZING ALPHA-OLEFIN BY CONTACTING WITH CATALYST SYSTEM COMPRISING BRIDGED FLUORENYL METALLOCENE CONTAINING METAL OF GROUP 4 OR 5 AND SUITABLE COCATALYST | PHILLIPS PETROLEUM COMPANY | 2002-06-11 | — | — | US | disclosed |
| CN-1170002-A | Processes to produce-aluminoxane compositions | PHILLIPS PETROLEUM CO (US) | 1998-01-14 | — | — | CN | disclosed |
| CN-1068829-A | Organometallic fluorenyl compounds and preparation thereof and application | PHILLIPS PETROLEUM CO (US) | 1993-02-10 | — | — | CN | disclosed |