Known targets — ChEMBL curated mechanism
GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQ
The experimentally established mechanism targets of Water. 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 | |
|---|---|---|---|---|
| Water SCHEMBL2694564 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL2022375 | 0.88 | — | — | |
| Fluoride Ion SCHEMBL28627329 | 0.88 | — | — | |
| Zinc Ion SCHEMBL8400553 | 0.88 | LMNA (0.33) | — | |
| Water SCHEMBL2693536 | 0.88 | — | — | |
| Water SCHEMBL2696061 | 0.88 | — | — | |
| Water SCHEMBL4586552 | 0.88 | — | — | |
| Water SCHEMBL2693752 | 0.88 | — | — | |
| Zinc Ion SCHEMBL8426952 | 0.88 | — | — | |
| Boric Acid SCHEMBL4598480 | 0.82 | LMNA (0.44) | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-12168747-B2 | Aerogel compositions for high temperature applications | ASPEN AEROGELS, INC. (US) | 2024-12-17 | — | — | US | disclosed |
| US-20240360363-A1 | AEROGEL COMPOSITIONS FOR HIGH TEMPERATURE APPLICATIONS | ASPEN AEROGELS, INC. | 2024-10-31 | — | — | US | disclosed |
| CN-113512249-B | Zinc hydroxide borate and whisker synergistic flame-retardant ethylene-vinyl acetate copolymer/low-density polyethylene composite material and preparation method thereof | 常熟市中联光电新材料有限责任公司 | 2023-05-02 | — | — | CN | disclosed |
| CN-113512249-B | Zinc hydroxide borate and whisker synergistic flame-retardant ethylene-vinyl acetate copolymer/low-density polyethylene composite material and preparation method thereof | 常熟市中联光电新材料有限责任公司 | 2023-05-02 | — | — | CN | disclosed |
| US-11634641-B2 | Aerogel compositions for high temperature applications | ASPEN AEROGELS, INC. (US) | 2023-04-25 | — | — | US | disclosed |
| US-11549059-B2 | Aerogel compositions with enhanced performance | MIDCAP FUNDING IV TRUST | 2023-01-10 | — | — | US | disclosed |
| US-11261380-B2 | Aerogel compositions for high temperature applications | MIDCAP FUNDING IV TRUST | 2022-03-01 | — | — | US | disclosed |
| CN-113512249-A | Zinc hydroxide borate and whisker synergistic flame-retardant ethylene-vinyl acetate copolymer/low-density polyethylene composite material and preparation method thereof | 常熟市中联光电新材料有限责任公司 | 2021-10-19 | — | — | CN | disclosed |
| CN-113512249-A | Zinc hydroxide borate and whisker synergistic flame-retardant ethylene-vinyl acetate copolymer/low-density polyethylene composite material and preparation method thereof | 常熟市中联光电新材料有限责任公司 | 2021-10-19 | — | — | CN | disclosed |
| US-20210207032-A1 | AEROGEL COMPOSITIONS FOR HIGH TEMPERATURE APPLICATIONS | ASPEN AEROGELS, INC. (US) | 2021-07-08 | — | — | US | disclosed |
| US-20210198578-A1 | AEROGEL COMPOSITIONS FOR HIGH TEMPERATURE APPLICATIONS | ASPEN AEROGELS, INC. (US) | 2021-07-01 | — | — | US | disclosed |
| US-20210079300-A1 | AEROGEL COMPOSITIONS WITH ENHANCED PERFORMANCE | ASPEN AEROGELS, INC. (US) | 2021-03-18 | — | — | US | disclosed |
| US-20200061569-A1 | AEROGEL COMPOSITIONS FOR HIGH TEMPERATURE APPLICATIONS | ASPEN AEROGELS, INC. (US) | 2020-02-27 | — | — | US | disclosed |
| CN-108752635-A | A kind of preparation method and application of magnesium hydroxide-zinc borate composite flame-retardant agent | 广东宇星阻燃新材股份有限公司 | 2018-11-06 | — | — | CN | disclosed |
| CN-108138001-A | Adhesive article with grip | 日东电工株式会社 | 2018-06-08 | — | — | CN | disclosed |
| US-20160046867-A1 | AEROGEL COMPOSITIONS WITH ENHANCED PERFORMANCE | MIDCAP FUNDING IV TRUST | 2016-02-18 | — | — | US | disclosed |
| US-9181486-B2 | Aerogel compositions with enhanced performance | ASPEN AEROGELS, INC. (US) | 2015-11-10 | — | — | US | disclosed |
| WO-2007140293-A2 | AEROGEL COMPOSITIONS WITH ENHANCED PERFORMANCE | ASPEN AEROGELS, INC. (US) | 2007-12-06 | — | — | WO | disclosed |
| US-20070272902-A1 | AEROGEL COMPOSITIONS WITH ENHANCED PERFORMANCE | ASPEN AEROGELS, INC. (US) | 2007-11-29 | — | — | US | disclosed |