SCHEMBL742015

SCHEMBL742015

CCC(C)(C)OC([NH])=O

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
SCHEMBL224524 0.80 LMNA (0.38)
SCHEMBL2012116 0.79 CYP1A2 (0.34)
SCHEMBL475144 0.78 TSHR (0.43)
SCHEMBL1121870 0.78 TSHR (0.43)
SCHEMBL14982575 0.78
SCHEMBL8813599 0.77
SCHEMBL8813842 0.77
SCHEMBL8811134 0.77
SCHEMBL8811270 0.77
SCHEMBL3315046 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11767295-B2 Isoindole derivative TIANJIN HEMAY PHARMACEUTICAL CO., LTD. (CN) 2023-09-26 US claimed
US-20210155590-A1 ISOINDOLE DERIVATIVE TIANJIN HEMAY PHARMACEUTICAL CO., LTD. (CN) 2021-05-27 US claimed
EP-3782983-A1 ISOINDOLE DERIVATIVE Tianjin Hemay Pharmaceutical Co., Ltd. (CN) 2021-02-24 EP claimed
WO-2019201255-A1 ISOINDOLE DERIVATIVE 天津合美医药科技有限公司 2019-10-24 WO claimed
EP-1906945-B1 HCV INHIBITORS VIROBAY INC (US) 2015-08-05 EP claimed
EP-2431379-A2 HCV inhibitors Virobay, Inc. (US) 2012-03-21 EP claimed
US-20100266537-A1 HCV INHIBITORS VIROBAY, INC. (US) 2010-10-21 US claimed
US-7608592-B2 HCV inhibitors VIROBAY, INC. (US) 2009-10-27 US claimed
EP-1906945-A4 HCV INHIBITORS VIROBAY INC (US) 2009-07-15 EP claimed
WO-2008086053-A1 HCV INHIBITORS VIROBAY, INC. (US) 2008-07-17 WO claimed
US-20080161254-A1 HCV INHIBITORS VIROBAY, INC. (US) 2008-07-03 US claimed
EP-1906945-A2 HCV INHIBITORS Virobay, Inc. (US) 2008-04-09 EP claimed
US-20070054864-A1 1-[2S-(3-Tert-butylureido)-3,3-dimethylbutyryl]-4R-(7-methoxy-2-pyrazol-1-yl-quinolin-4-yloxy)-pyrrolidine-2S-carboxylic acid (1S-cyclopropylaminooxalylbutyl)amide, for example; useful in treating hepatitis C infections QUEST DIAGNOSTICS INVESTMENTS LLC 2007-03-08 US claimed
WO-2007005838-A2 HCV INHIBITORS VIROBAY, INC. (US) 2007-01-11 WO claimed
WO-2024096066-A1 CYCLIC PEPTIDE DERIVATIVE COMPOSITION FOR TREATING OR PREVENTING CENTRAL NERVOUS SYSTEM INJURY/DISEASE 第一工業製薬株式会社 2024-05-10 WO disclosed
WO-2024096067-A1 CYCLIC PEPTIDE DERIVATIVE COMPOSITION FOR TREATING OR PREVENTING NEUROPATHIC PAIN AND/OR INFLAMMATORY PAIN 第一工業製薬株式会社 2024-05-10 WO disclosed
EP-4361148-A1 HETEROCYCLOALKYL-SUBSTITUTED POLYHETEROAZOLE DERIVATIVE AS MEDICAL DRUG FOR TREATMENT AND/OR PREVENTION OF RS VIRUS INFECTIOUS DISEASE Albius Sciences Alpha Private Limited (SG) 2024-05-01 EP disclosed
US-4025509-A Aminopyridinium acetyl cephalosporanes CIBA-GEIGY CORPORATION (US) 1977-05-24 US disclosed
US-3996208-A PENICILLINS CIBA-GEIGY CORPORATION (US) 1976-12-07 US disclosed
US-3954802-A Substituted-ureido derivatives of penam 3-carboxylic acid and cephem 4-carboxylic acid CIBA-GEIGY CORPORATION (US) 1976-05-04 US disclosed