⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7529536 | 0.84 | ALDH1A1 (0.42) | — | |
| SCHEMBL14112035 | 0.70 | — | — | |
| SCHEMBL5944 | 0.70 | — | — | |
| Bromide SCHEMBL313669 | 0.67 | — | — | |
| SCHEMBL21407669 | 0.67 | — | — | |
| SCHEMBL6885298 | 0.67 | — | — | |
| Lithium SCHEMBL1395029 | 0.67 | — | — | |
| Ammonia Solution, Strong SCHEMBL7070777 | 0.67 | — | — | |
| SCHEMBL17606 | 0.67 | — | — | |
| SCHEMBL9389522 | 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 55 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1512707-B1 | Open celled rigid polyurethane foams | BASF SE (DE) | 2009-09-30 | — | — | EP | claimed |
| WO-2006066763-A1 | METHOD FOR PRODUCING MICROCELLULAR POLYURETHANE ELASTOMERS | BASF AKTIENGESELLSCHAFT (DE) | 2006-06-29 | — | — | WO | claimed |
| EP-1512707-A2 | Open celled rigid polyurethane foams | BASF AKTIENGESELLSCHAFT (DE) | 2005-03-09 | — | — | EP | claimed |
| EP-0896010-A1 | Mixtures containing organic amines and polycarboxylic acids | BASF AKTIENGESELLSCHAFT (DE) | 1999-02-10 | — | — | EP | claimed |
| EP-2072548-B1 | Method for manufacturing rigid foams containing urethane and isocyanurate groups | BASF SE (DE) | 2017-02-22 | — | — | EP | disclosed |
| WO-2016130818-A1 | SUBSTITUTED PYRAZOLE COMPOUNDS AS RORgammaT INHIBITORS AND USES THEREOF | MERCK SHARP & DOHME CORP. (US) | 2016-08-18 | — | — | WO | disclosed |
| EP-2121793-B1 | DISPERSIONS OF POLYURETHANES, THEIR PREPARATION AND USE | BASF SE (DE) | 2016-07-13 | — | — | EP | disclosed |
| EP-2313451-B1 | USE OF AQUEOUS POLYURETHANE DISPERSIONS IN PRINTING INKS AND CORRESPONDING PRINTING PROCESS | BASF SE (DE) | 2012-09-19 | — | — | EP | disclosed |
| EP-1599519-B1 | METHOD FOR PRODUCING AQUEOUS POLYURETHANE DISPERSIONS IN MINIEMULSION AND IN THE PRESENCE OF A CATALYST | BASF SE (DE) | 2012-08-01 | — | — | EP | disclosed |
| EP-1208132-B1 | POLYETHER ALCOHOLS | BASF SE (DE) | 2011-07-20 | — | — | EP | disclosed |
| EP-2313451-A1 | USE OF AQUEOUS POLYURETHANE DISPERSIONS IN PRINTING INKS AND CORRESPONDING PRINTING PROCESS | BASF SE (DE) | 2011-04-27 | — | — | EP | disclosed |
| EP-1175454-B2 | METHOD FOR THE PRODUCTION OF POLYURETHANES | BASF SE (DE) | 2011-03-30 | — | — | EP | disclosed |
| EP-1170314-A1 | Polyisocyanate polyaddition products based on polyols with low unsaturation | BASF AKTIENGESELLSCHAFT (DE) | 2002-01-09 | — | — | EP | disclosed |
| EP-1162230-A1 | Cellular polyisocyanate-polyaddition products | BASF AKTIENGESELLSCHAFT (DE) | 2001-12-12 | — | — | EP | disclosed |
| WO-2001016209-A1 | POLYETHER ALCOHOLS | BASF AKTIENGESELLSCHAFT (DE) | 2001-03-08 | — | — | WO | disclosed |
| EP-1048677-A1 | Mixtures for preparing polyisocyanate-polyaddition products | BASF AKTIENGESELLSCHAFT (DE) | 2000-11-02 | — | — | EP | disclosed |
| WO-2000063270-A1 | METHOD FOR THE PRODUCTION OF POLYURETHANES | BASF AKTIENGESELLSCHAFT (DE) | 2000-10-26 | — | — | WO | disclosed |
| EP-0982336-A1 | Mixture containing isocyanates as well as organic and/ or inorganic acids or acid derivatives | BASF AKTIENGESELLSCHAFT (DE) | 2000-03-01 | — | — | EP | disclosed |
| EP-0896011-A1 | Mixtures containing polycarboxylic acids and compounds containing at least one hydroxy and/or amino group reactive towards isocyanates | BASF AKTIENGESELLSCHAFT (DE) | 1999-02-10 | — | — | EP | disclosed |
| EP-0896010-A1 | Mixtures containing organic amines and polycarboxylic acids | BASF AKTIENGESELLSCHAFT (DE) | 1999-02-10 | — | — | EP | disclosed |