⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5983098 | 0.80 | ESR1 (0.36) | — | |
| SCHEMBL7165514 | 0.71 | IDO1 (0.41) | — | |
| SCHEMBL5982515 | 0.68 | TAAR1 (0.33) | — | |
| SCHEMBL3978129 | 0.67 | TAAR1 (0.45) | — | |
| SCHEMBL6282930 | 0.66 | TAAR1 (0.54) | — | |
| SCHEMBL17026792 | 0.65 | MAPT (0.35) | — | |
| SCHEMBL8508653 | 0.64 | KIF11 (0.45) | — | |
| SCHEMBL24375976 | 0.64 | ESR1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL7857894 | 0.64 | TAAR1 (0.52) | — | |
| SCHEMBL4856152 | 0.63 | KIF11 (0.50) | — |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10385177-B2 | Reactivity drift and catalyst degradation in polyurethane foam | FOAM SUPPLIES, INC. (US) | 2019-08-20 | — | — | US | disclosed |
| US-20060030633-A1 | Reactivity drift and catalyst degradation in polyurethane foam | FOAM SUPPLIES, INC. | 2006-02-09 | — | — | US | disclosed |
| US-5585412-A | REACTING POLYOL, ISOCYANATE, WATER, ENCAPSULATED BLOWING AGENT, RUPTURING SHELL OF BLOWING AGENT | OLIN CORPORATION (US) | 1996-12-17 | — | — | US | disclosed |
| US-5328938-A | Monochlorodifluoromethane as foaming agents for closed cell or semi-rigid foams | BASF CORPORATION (US) | 1994-07-12 | — | — | US | disclosed |
| US-5264464-A | Chlorodifluoromethane | BASF CORPORATION (US) | 1993-11-23 | — | — | US | disclosed |
| WO-1992019670-A1 | ON-SITE GENERATION OF POLYURETHANE FOAM USING AN HCFC AS A SOLE BLOWING AGENT | OLIN CORPORATION (US) | 1992-11-12 | — | — | WO | disclosed |
| WO-1992019681-A1 | PROCESS FOR PRODUCING AN ANTIMICROBIALLY EFFECTIVE POLYURETHANE | OLIN CORPORATION (US) | 1992-11-12 | — | — | WO | disclosed |
| US-5114984-A | Dissolving pyrithione salt in alkanolamine; polymerization of polyol and polyisocyanate | OLIN CORPORATION (US) | 1992-05-19 | — | — | US | disclosed |
| US-5112878-A | Free of CFC blowing agents | OLIN CORPORATION (US) | 1992-05-12 | — | — | US | disclosed |
| US-4766158-A | CATALYTIC REACTION OF POLYISOCYANATES AND POLYEPOXIDE | OLIN CORPORATION (US) | 1988-08-23 | — | — | US | disclosed |
| US-4699931-A | REACTING POLYISOCYANATE WITH POLYEPOXIDE-THERMAL STABILITY | OLIN CORPORATION (US) | 1987-10-13 | — | — | US | disclosed |
| US-4699932-A | UREA-AND WATER-FREE | OLIN CORPORATION (US) | 1987-10-13 | — | — | US | disclosed |
| US-4221877-A | Modified diphenylmethane diisocyanates useful in polyurethanes or polyisocyanurates | TEXACO DEVELOPMENT CORP. (US) | 1980-09-09 | — | — | US | disclosed |
| US-4126741-A | High-modulus polyisocyanurate elastomers | THE UPJOHN COMPANY (US) | 1978-11-21 | — | — | US | disclosed |
| US-4126742-A | High-modulus polyisocyanurate elastomers | THE UPJOHN COMPANY (US) | 1978-11-21 | — | — | US | disclosed |