⚠ 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL28717082 | 0.96 | — | — | |
| SCHEMBL28717080 | 0.93 | — | — | |
| SCHEMBL8769957 | 0.86 | — | — | |
| SCHEMBL11351205 | 0.79 | — | — | |
| SCHEMBL6691635 | 0.79 | — | — | |
| SCHEMBL183061 | 0.76 | MEN1 (0.36) | — | |
| SCHEMBL183480 | 0.74 | — | — | |
| SCHEMBL7047958 | 0.74 | — | — | |
| SCHEMBL2876489 | 0.74 | — | — | |
| SCHEMBL8910390 | 0.73 | MEN1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2170926-B1 | PROCESS FOR THE PREPARATION OF 17-(3-HYDROXYPROPYL)-17-HYDROXYSTEROIDS | BAYER IP GMBH (DE) | 2014-07-23 | — | — | EP | disclosed |
| EP-1359921-A4 | METHODS TO TREAT AUTOIMMUNE AND INFLAMMATORY CONDITIONS | NEWBIOTICS INC (US) | 2006-09-06 | — | — | EP | disclosed |
| EP-1359921-A2 | METHODS TO TREAT AUTOIMMUNE AND INFLAMMATORY CONDITIONS | NewBiotics, Inc. (US) | 2003-11-12 | — | — | EP | disclosed |
| WO-2002056832-A2 | METHODS TO TREAT AUTOIMMUNE AND INFLAMMATORY CONDITIONS | NEWBIOTICS, INC. (US) | 2002-07-25 | — | — | WO | disclosed |
| EP-1200130-A2 | METHODS FOR TREATING THERAPY-RESISTANT TUMORS | Newbiotics, Inc. (US) | 2002-05-02 | — | — | EP | disclosed |
| EP-1200455-A1 | ENZYME CATALYZED THERAPEUTIC ACTIVATION | Newbiotics Inc. (US) | 2002-05-02 | — | — | EP | disclosed |
| WO-2001007454-A1 | ENZYME CATALYZED THERAPEUTIC ACTIVATION | NEWBIOTICS, INC. (US) | 2001-02-01 | — | — | WO | disclosed |
| WO-2001007088-A2 | METHODS FOR TREATING THERAPY-RESISTANT TUMORS | NEWBIOTICS, INC. (US) | 2001-02-01 | — | — | WO | disclosed |
| US-5693628-A | HORMON INHIBITOR, ANTIFERTILITY AGENT AND CONTRACEPTIVES | JENAPHARM GMBH (DE) | 1997-12-02 | — | — | US | disclosed |
| US-5318989-A | Antitumor and -carcinogenic agents; antibiotics; aglycones of esperamycins and calichemicins and having the same mechanism of bioactivity | BRISTOL-MYERS SQUIBB COMPANY (US) | 1994-06-07 | — | — | US | disclosed |
| EP-0538898-A2 | Cytotoxic bicyclo (7.3.1)-tridec-4-ene-2,6-diyne compounds and process for the preparation thereof | Bristol-Myers Squibb Company (US) | 1993-04-28 | — | — | EP | disclosed |
| US-5198560-A | Antitumor agents based on esperamicin antibiotics | BRISTOL-MYERS SQUIBB COMPANY (US) | 1993-03-30 | — | — | US | disclosed |
| EP-0454146-A1 | Cytotoxic bicyclo[7.3.1] tridec-4-ene-2,6-diyne compounds and process for the preparation thereof | Bristol-Myers Squibb Company (US) | 1991-10-30 | — | — | EP | disclosed |
| US-4873360-A | Process for the preparation of cyclopentanoids and novel intermediates produced thereby | BOARD OF GOVERNORS OF WAYNE STATE UNIVERSITY (US) | 1989-10-10 | — | — | US | disclosed |
| US-4784996-A | Pyrimidoindoles useful as hypoglycaemics | JOHN WYETH & BROTHER LTD. (GB) | 1988-11-15 | — | — | US | disclosed |
| US-4390721-A | 3-Endo-protected hydroxyl-tricyclo[3,2,0,02,7 ]heptan-6-ones | ALLEN & HANBURYS LIMITED (GB) | 1983-06-28 | — | — | US | disclosed |
| US-4181674-A | 5-Endo-protected hydroxyl-bicyclo[2,2,1]-heptan-2-ones and process for preparing same | ALLEN & HANBURYS LIMITED (GB) | 1980-01-01 | — | — | US | disclosed |
| US-4134911-A | 3-Endo-protected hydroxyl-tricyclo[3,2,0,02,7 ]-heptan-6-ones | ALLEN & HANBURYS LIMITED (GB) | 1979-01-16 | — | — | US | disclosed |
| US-3940425-A | Process for the production of polyunsaturated compounds | BAYER AKTIENGESELLSCHAFT (DT) | 1976-02-24 | — | — | US | disclosed |