SCHEMBL5137103

SCHEMBL5137103

[CH2]CCOC(=O)CN

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL7656353 0.85
SCHEMBL3121478 0.83 GLRA1 (0.39)
Hydrochloric Acid SCHEMBL7675204 0.80 HTR2C (0.38)
Hydrochloric Acid SCHEMBL7675200 0.80 HTR2C (0.38)
SCHEMBL8923707 0.80
SCHEMBL8979257 0.78
SCHEMBL6116526 0.78
SCHEMBL6682800 0.78 HTR2C (0.50)
SCHEMBL5496994 0.78 HTR2C (0.45)
SCHEMBL106360 0.78

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1038475-C Anticoccidial composition HOFFMANN LA ROCHE (CH) 1998-05-27 CN claimed
EP-0290998-B1 ANTICOCCIDIAL COMPOSITION F. HOFFMANN-LA ROCHE AG (CH) 1992-08-12 EP claimed
US-4839382-A SYNERGISTIC MIXTURE OF FRENOLICIN B AND AN IONOPHOROUS POLYETHER ANTIBIOTIC HOFFMANN-LA ROCHE INC. (US) 1989-06-13 US claimed
CN-1030527-A Anti-coccidiosis composition HOFFMANN LA ROCHE (CH) 1989-01-25 CN claimed
EP-0290998-A2 Anticoccidial composition F. HOFFMANN-LA ROCHE AG (CH) 1988-11-17 EP claimed
EP-1954774-A1 SILICONE-BASED HARD COATING COMPOSITION WITH MIDDLE AND HIGH REFRACTIVE INDEX, METHOD OF PREPARING THE SAME, AND OPTICAL LENS PREPARED THEREFROM LG Chem, Ltd. (KR) 2008-08-13 EP disclosed
WO-2007064107-A1 SILICONE-BASED HARD COATING COMPOSITION WITH MIDDLE AND HIGH REFRACTIVE INDEX, METHOD OF PREPARING THE SAME, AND OPTICAL LENS PREPARED THEREFROM LG CHEM, LTD. (KR) 2007-06-07 WO disclosed
CN-1658819-A Care and/or make-up cosmetic composition structured with silicone polymers and organogelling agents, in rigid form OREAL (FR) 2005-08-24 CN disclosed
US-6790881-B2 A SINGLE-LIQUID TYPE ADHESIVE CONTAINS A MAIN POLYMER, AN IMIDAZOLE SERVING AS A HARDENER(ITS SURFACE IS COVERED BY A THERMOPLASTIC RESIN), AND A HARDENING PROMOTER(ITS IMINO GROUP(-NH-) HAVING H REPLACED BY A REACTION RETARDER GROUP FUJITSU LIMITED (JP) 2004-09-14 US disclosed
US-20030069333-A1 Adhesive composition FUJITSU LIMITED (JP) 2003-04-10 US disclosed
CN-1038475-C Anticoccidial composition HOFFMANN LA ROCHE (CH) 1998-05-27 CN disclosed
EP-0290998-B1 ANTICOCCIDIAL COMPOSITION F. HOFFMANN-LA ROCHE AG (CH) 1992-08-12 EP disclosed
US-5063219-A Anticoccidial composition HOFFMANN-LA ROCHE INC. (US) 1991-11-05 US disclosed
US-4996198-A Mixture of 2,4-diamino-5-(trisubstituted)benzyl-pyrimidine potentiated sulfonamide antibiotic with an ionophorous polyether HOFFMANN-LA ROCHE INC. (US) 1991-02-26 US disclosed
US-4942207-A SILICONE OIL OR RESIN MODIFIED AND REACTED WITH EPOXY RESINS OR PHENOLIC RESINS KOREA CHEMICAL CO., LTD. (KR) 1990-07-17 US disclosed
US-4839382-A SYNERGISTIC MIXTURE OF FRENOLICIN B AND AN IONOPHOROUS POLYETHER ANTIBIOTIC HOFFMANN-LA ROCHE INC. (US) 1989-06-13 US disclosed
CN-1030527-A Anti-coccidiosis composition HOFFMANN LA ROCHE (CH) 1989-01-25 CN disclosed
EP-0290998-A2 Anticoccidial composition F. HOFFMANN-LA ROCHE AG (CH) 1988-11-17 EP disclosed
US-4594134-A Method for preparing a spherical cured polymer or a composition thereof containing linear organopolysiloxane blocks TORAY SILICONE COMPANY, LIMITED (JP) 1986-06-10 US disclosed