⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4148284 | 0.83 | KDM4E (0.31) | — | |
| SCHEMBL5862725 | 0.77 | — | — | |
| SCHEMBL1993811 | 0.76 | KAT2B (0.31) | — | |
| SCHEMBL5862721 | 0.76 | — | — | |
| SCHEMBL15709599 | 0.76 | ALOX5 (0.36) | — | |
| SCHEMBL5359904 | 0.72 | — | — | |
| SCHEMBL15422761 | 0.72 | — | — | |
| SCHEMBL204065 | 0.72 | — | — | |
| SCHEMBL591209 | 0.71 | — | — | |
| SCHEMBL2492553 | 0.71 | CYP3A4 (0.36) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104072731-B | Containing the multipolymer and its preparation method and application of thiophene-benzo two (selenole) | Haiyangwang Lighting Technology Co., Ltd. (CN) | 2016-02-10 | — | — | CN | disclosed |
| CN-104072731-A | Copolymer containing thiophene-benzo-bi(benzo selenium diazole) as well as preparation method and application thereof | OCEANS KING LIGHTING SCIENCE | 2014-10-01 | — | — | CN | disclosed |
| CN-103833961-A | Thiophene-silole di (benzo thiadiazole) copolymer and its preparation method and application | ZHOU MINGJIE | 2014-06-04 | — | — | CN | disclosed |