⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19655634 | 0.74 | — | — | |
| SCHEMBL4536609 | 0.73 | — | — | |
| SCHEMBL11560778 | 0.71 | — | — | |
| SCHEMBL6021608 | 0.71 | — | — | |
| SCHEMBL28824663 | 0.68 | — | — | |
| SCHEMBL10080745 | 0.68 | SRC (0.31) | — | |
| SCHEMBL18077369 | 0.67 | — | — | |
| SCHEMBL23115077 | 0.67 | — | — | |
| SCHEMBL7603719 | 0.67 | ACHE (0.34) | — | |
| SCHEMBL2185976 | 0.67 | CXCR3 (0.30) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10723719-B2 | Urea derivatives and uses thereof | KALA PHARMACEUTICALS, INC. (US) | 2020-07-28 | — | — | US | disclosed |
| US-20190284172-A1 | Urea Derivatives and Uses Thereof | KALA BIO, Inc. | 2019-09-19 | — | — | US | disclosed |
| US-10316022-B2 | Urea derivatives and uses thereof | KALA PHARMACEUTICALS, INC. (US) | 2019-06-11 | — | — | US | disclosed |
| WO-2018015328-A1 | UREA AND THIOUREA SUBSTITUTED BICYCLES DERIVATIVES AS PESTICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2018-01-25 | — | — | WO | disclosed |