SCHEMBL5582099

SCHEMBL5582099

N#CC(O)c1ccco1

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
SCHEMBL9669855 1.00 — —
SCHEMBL27536763 1.00 — —
SCHEMBL10480476 0.78 KMT2A (0.44) —
SCHEMBL6971969 0.77 — —
SCHEMBL11702005 0.77 — —
SCHEMBL8392647 0.76 KMT2A (0.40) —
SCHEMBL15272327 0.75 KMT2A (0.58) —
SCHEMBL11151822 0.75 KMT2A (0.58) —
SCHEMBL15272598 0.75 KMT2A (0.58) —
SCHEMBL10768232 0.74 KMT2A (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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119118967-A Preparation method of 2-furanone acid 重庆新征程生物医药有限公司 2024-12-13 — — CN claimed
EP-0510689-A1 Hydrocyanation of pentenenitriles using cyanohydrins E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-10-28 — — EP claimed
US-5107012-A Using an additive to promote dissociation of the cyanohydrin, a nickel complex catalyst and catalyst promoter; slurrying E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-04-21 — — US claimed
CN-119118967-A Preparation method of 2-furanone acid 重庆新征程生物医药有限公司 2024-12-13 — — CN disclosed
CN-119118967-A Preparation method of 2-furanone acid 重庆新征程生物医药有限公司 2024-12-13 — — CN disclosed
EP-2210889-A1 Process for producing pyrimidine compound Eisai R&D Management Co., Ltd. (JP) 2010-07-28 — — EP disclosed
EP-1862463-A1 PYRIMIDINE COMPOUND CRYSTAL OR AMORPHOUS FORM AND PROCESS FOR PRODUCING THE SAME Eisai R&D Management Co., Ltd. (JP) 2007-12-05 — — EP disclosed
US-7300784-B2 Nitrile hydratase and a method for producing amides DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2007-11-27 — — US disclosed
EP-1160235-B1 A method for producing alpha-hydroxycarboxylic acid NIPPON CATALYTIC CHEM IND (JP) 2006-09-20 — — EP disclosed
US-6900037-B2 Method for producing amide compounds DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2005-05-31 — — US disclosed
US-6864389-B2 Method for producing α-hydroxycarboxylic acid NIPPON SHOKUBAI CO., LTD. (JP) 2005-03-08 — — US disclosed
EP-0365045-A1 Perhydrothiazepine derivatives, their preparation and their therapeutic use SANKYO COMPANY LIMITED (JP) 1990-04-25 — — EP disclosed
US-4859784-A Process for the production of optically active cyanohydrins DEGUSSA AKTIENGESELLSCHAFT (DE) 1989-08-22 — — US disclosed
EP-0276375-A2 Process for the preparation of optically active alpha-hydroxynitriles Degussa Aktiengesellschaft (DE) 1988-08-03 — — EP disclosed
US-4699905-A HYPOTENSIVE AGENTS SANKYO COMPANY, LIMITED (JP) 1987-10-13 — — US disclosed
EP-0161801-A2 Perhydrothiazepine derivatives, their preparation and their therapeutic use SANKYO COMPANY LIMITED (JP) 1985-11-21 — — EP disclosed
US-4107178-A Thioprene or furan derivatives and process for preparation thereof SAGAMI CHEMICAL RESEARCH CENTER (JP) 1978-08-15 — — US disclosed
US-4086420-A Thioprene or furan derivatives and process for preparation thereof SAGAMI CHEMICAL RESEARCH CENTER (JA) 1978-04-25 — — US disclosed
US-4076732-A Derivatives of α-(6-carboxyhexyl) furfuryl alcohol AMERICAN CYANAMID COMPANY (US) 1978-02-28 — — US disclosed
US-4051151-A Thiophene derivatives and process for preparation thereof SAGAMI CHEMICAL RESEARCH CENTER (JA) 1977-09-27 — — US disclosed
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