SCHEMBL4242

SCHEMBL4242

COc1cc[c]c(F)c1

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
SCHEMBL919676 0.87 SMN1; SMN2 (0.50)
SCHEMBL921863 0.86 LTA4H (0.45)
SCHEMBL20875253 0.82 NFE2L2 (0.36)
SCHEMBL920733 0.79 MAOB (0.62)
SCHEMBL23166624 0.79 CYP1A1 (0.48)
SCHEMBL920022 0.79 MAOB (0.53)
SCHEMBL17514703 0.78 CYP1A1 (0.52)
SCHEMBL21680793 0.78
SCHEMBL6655416 0.78 GRM5 (0.31)
SCHEMBL6019039 0.78 ABL1 (0.46)

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 1741 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4380933-A1 MICROBIOCIDAL PYRAZOLE DERIVATIVES Syngenta Crop Protection AG (CH) 2024-06-12 EP claimed
US-RE49934-E1 Inhibitors of cellular metabolic processes SERVIER PHARMACEUTICALS LLC (US) 2024-04-23 US claimed
EP-4346411-A1 MICROBIOCIDAL TETRAHYDROISOQUINOLINE DERIVATIVES Syngenta Crop Protection AG (CH) 2024-04-10 EP claimed
WO-2024068947-A1 MICROBIOCIDAL PYRAZOLE DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2024-04-04 WO claimed
EP-4345101-A1 AZOLE DERIVATIVES AS SHP2 INHIBITORS IRBM S.P.A. (IT) 2024-04-03 EP claimed
CN-112004813-B Oxadiazole compounds for controlling phytopathogenic fungi PI工业有限公司 2024-03-29 CN claimed
CN-117769551-A Microbiocidal pyrazole derivatives 先正达农作物保护股份公司 2024-03-26 CN claimed
CN-117586206-A Pterocarpus stilbene piperidine amide derivative, preparation method and medical application thereof 安徽中医药大学 2024-02-23 CN claimed
CN-117396073-A Microbiocidal tetrahydroisoquinoline derivatives 先正达农作物保护股份公司 2024-01-12 CN claimed
EP-3901147-B1 ACYLAMINO BRIDGED HETEROCYCLIC COMPOUND, AND COMPOSITION AND APPLICATION THEREOF BEIJING SCITECH MQ PHARMACEUTICALS LTD (CN) 2023-11-22 EP claimed
EP-0121979-B1 AZOLYLMETHYL TETRAHYDROFURAN DERIVATIVES AS PLANT GROWTH REGULATORS AND FUNGICIDES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-09-26 EP claimed
US-4859228-A Novel 5-aminomethylene-2,4-imidazolidinediones and 5-aminomethylene-2-thionoimidazolidine-4-ones ICI AMERICAS INC (US) 1989-08-22 US claimed
EP-0089100-B1 AZOLYL DERIVATIVES AS FUNGICIDES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1989-05-31 EP claimed
EP-0300882-A2 Novel 5-Aminomethylene-2,4-imidazolidinediones and 5-aminomethylene-2-thionoimidazolidine-4-ones ICI AMERICAS INC. (US) 1989-01-25 EP claimed
EP-0097425-B1 FUNGICIDAL OR PLANT GROWTH REGULATING TRIAZOLYL ETHANOLS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-04-08 EP claimed
US-4518415-A PLANT GROWTH REGULATORS, FUNGICIDES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-05-21 US claimed
EP-0048548-B1 PHARMACEUTICAL COMPOSITIONS OF FUNGICIDAL TRIAZOLE DERIVATIVES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-11-14 EP claimed
EP-0097425-A2 Fungicidal or plant growth regulating triazolyl ethanols IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-01-04 EP claimed
EP-0089100-A2 Azolyl derivatives as fungicides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-09-21 EP claimed
EP-0048548-A1 Pharmaceutical compositions of fungicidal triazole derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-03-31 EP claimed