SCHEMBL425320

SCHEMBL425320

NC(=O)OC(F)(F)F

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
SCHEMBL866839 0.80 ALDH1A1 (0.31)
SCHEMBL11101220 0.76
SCHEMBL11102012 0.76 CD69 (0.38)
SCHEMBL29804509 0.75 GAA (0.35)
SCHEMBL1767313 0.75
SCHEMBL10061822 0.75
Methyl Carbamate SCHEMBL29804063 0.73 ALDH1A1 (0.41)
SCHEMBL865177 0.73
SCHEMBL225843 0.72
SCHEMBL11269809 0.71 KDM4E (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110272403-A A method of carbamate of the synthesis containing chroman ring and trifluoromethyl 华南理工大学 2019-09-24 CN claimed
US-7786259-B2 Attachment and elaboration strategies for inverse peptide synthesis THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2010-08-31 US claimed
US-20080039612-A1 ATTACHMENT AND ELABORATION STRATEGIES FOR INVERSE PEPTIDE SYNTHESIS THE CURATORS OF THE UNIVERSITY OF MISSOURI 2008-02-14 US claimed
US-20030158210-A1 Amino acid ester containing azole antifungals MEERPOEL LIEVEN (BE) 2003-08-21 US claimed
US-20010039281-A1 Amino acid ester containing azole antifungals MEERPOEL LIEVEN (BE) 2001-11-08 US claimed
US-6262052-B1 Amino acid ester containing azole antifungals JANSSEN PHARMACEUTICA N.V. (BE) 2001-07-17 US claimed
EP-0958289-A1 AMINO ACID ESTER CONTAINING AZOLE ANTIFUNGALS JANSSEN PHARMACEUTICA N.V. (BE) 1999-11-24 EP claimed
WO-1998034934-A1 AMINO ACID ESTER CONTAINING AZOLE ANTIFUNGALS JANSSEN PHARMACEUTICA N.V. (BE) 1998-08-13 WO claimed
CN-114072000-A Molecules having certain pesticidal effects and intermediates, compositions and methods related thereto 科迪华农业科技有限责任公司 2022-02-18 CN disclosed
EP-3883920-A1 N-TRIFLUORMETHYLCARBONYL COMPOUNDS AND METHODS FOR THEIR SYNTHESIS Rheinisch-Westfälische Technische Hochschule (RWTH) Aachen (DE) 2021-09-29 EP disclosed
CN-108431001-B Fused ring pyrimidine compound or salt thereof 大鹏药品工业株式会社 2021-09-17 CN disclosed
CN-113166135-A Benzothiophene derivative modulators, methods of making, and uses thereof 上海翰森生物医药科技有限公司 2021-07-23 CN disclosed
EP-3081552-B1 PEST CONTROL AGENT CONTAINING AN AMIDE DERIVATIVE AND USE OF THE PEST CONTROL AGENT MITSUI CHEMICALS AGRO INC (JP) 2021-03-03 EP disclosed
EP-3381916-B1 CONDENSED PYRIMIDINE COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2020-04-15 EP disclosed
US-5691319-A ANTICARCINOGENIC AGENTS SANKYO COMPANY, LIMITED (JP) 1997-11-25 US disclosed
EP-0765879-A1 13-Substituted milbemycin 5-oxime derivatives, their preparation and their use against insects and other pests SANKYO COMPANY LIMITED (JP) 1997-04-02 EP disclosed
CN-1033227-C Pyrimidine nucleoside derivatives having anti-tumor activity, their preparation and their use. SANKYO CO (JP) 1996-11-06 CN disclosed
EP-0536936-B1 Pyrimidine nucleoside derivatives having anti-tumor activity, their preparation and use SANKYO CO (JP) 1996-08-14 EP disclosed
CN-1072686-A Has Pyrmidine nucleoside derivatives of anti-tumor activity and its production and use SANKYO CO (JP) 1993-06-02 CN disclosed
EP-0536936-A1 Pyrimidine nucleoside derivatives having anti-tumor activity, their preparation and use Sankyo Company Limited (JP) 1993-04-14 EP disclosed