SCHEMBL166624

SCHEMBL166624

[CH2]CCNC(=O)OC(C)(C)C

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.58
MEN1 O00255 1/20 0.55
GAA P10253 1/20 0.55
KMT2A Q03164 1/20 0.55
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
CA12 O43570 6/20 0.47
CA1 P00915 6/20 0.47
CA2 P00918 6/20 0.47
CA9 Q16790 6/20 0.47
EPHX1 P07099 1/20 0.47
HTT P42858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ALDH1A1 P00352 2/20 0.42
GFER P55789 1/20 0.42
MALT1 Q9UDY8 1/20 0.41
IDO1 P14902 1/20 0.41
BCHE P06276 1/20 0.39
NQO2 P16083 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL166207 0.88 TDP1 (0.65) TDP1MEN1GAAKMT2AMAOA
SCHEMBL3341020 0.86 TDP1 (0.67) TDP1MEN1GAAKMT2AMAOA
SCHEMBL3475950 0.86 TDP1 (0.68) TDP1MEN1GAAKMT2AMAOA
SCHEMBL7074276 0.84 TDP1 (0.71) TDP1MEN1GAAKMT2AMAOA
SCHEMBL7080001 0.84 TDP1 (0.71) TDP1MEN1GAAKMT2AMAOA
SCHEMBL1263135 0.84 TDP1 (0.71) TDP1MEN1GAAKMT2AMAOA
SCHEMBL7081323 0.84 TDP1 (0.71) TDP1MEN1GAAKMT2AMAOA
SCHEMBL10431151 0.84 TDP1 (0.71) TDP1MEN1GAAKMT2AMAOA
SCHEMBL3020258 0.82 TDP1 (0.81) TDP1MEN1GAAKMT2AMAOA
SCHEMBL208786 0.82 TDP1 (0.52) TDP1MEN1GAAKMT2AMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114276411-B Solid phase synthesis method of cyclic peptide compound containing trithioether bond 北京大学深圳研究生院 2024-02-09 CN claimed
CN-114276411-A Solid phase synthesis method of cyclic peptide compound containing trithioether bond 北京大学深圳研究生院 2022-04-05 CN claimed
CN-113874375-A Cyclic amide compounds and methods thereof for the treatment of rabies 株式会社大分大学先端医学研究所 2021-12-31 CN claimed
US-10968319-B2 Silicone hydrogel contact lenses ALCON INC. (CH) 2021-04-06 US claimed
EP-3759528-A1 SILICONE HYDROGEL CONTACT LENSES Alcon Inc. (CH) 2021-01-06 EP claimed
EP-3067355-B1 CRYSTALS OF DIAZABICYCLOOCTANE DERIVATIVE AND PRODUCTION METHOD FOR CRYSTALS OF DIAZABICYCLOOCTANE DERIVATIVE MEIJI SEIKA PHARMA CO LTD (JP) 2020-12-16 EP claimed
WO-2020246503-A1 CYCLIC AMIDE COMPOUNDS FOR RABIES TREATMENT AND METHOD THEREOF 株式会社大分大学先端医学研究所 2020-12-10 WO claimed
CN-111757880-A Method for synthesizing cyclic depsipeptides 拜耳动物保健有限责任公司 2020-10-09 CN claimed
EP-3676265-A1 METHOD FOR THE SYNTHESIS OF CYCLIC DEPSIPEPTIDES Bayer Animal Health GmbH (DE) 2020-07-08 EP claimed
CN-111153903-A Crystal of diazabicyclooctane derivative, preparation method and application thereof, and pharmaceutical composition 明治制果药业株式会社 2020-05-15 CN claimed
WO-2000039083-A2 PYRAZOLE COMPOUNDS AND USES THEREOF PPD DISCOVERY, INC. (US) 2000-07-06 WO claimed
EP-0973389-A1 NITROGEN-CONTAINING OXYALKYLENE ESTERS AND USES THEREOF BAR-ILAN UNIVERSITY (IL) 2000-01-26 EP claimed
EP-0929530-A1 QUINAZOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ZENECA LIMITED (GB) 1999-07-21 EP claimed
US-5856324-A Use of dioxomorpholines for combat endoparasites, dioxomorpholines and process for their production BAYER AKTIENGESELLSCHAFT (DE) 1999-01-05 US claimed
WO-1998039966-A1 NITROGEN-CONTAINING OXYALKYLENE ESTERS AND USES THEREOF BAR-ILAN UNIVERSITY (IL) 1998-09-17 WO claimed
WO-1998013354-A1 QUINAZOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ZENECA LIMITED (GB) 1998-04-02 WO claimed
US-5571793-A COMBATTING ENDOPARASITES IN HUMANS OR ANIMALS BY ADMINISTERING PEPTIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-11-05 US claimed
EP-0007470-B1 CEPHEM COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-10-12 EP claimed
US-4268509-A BACTERICIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-05-19 US claimed
EP-0007470-A2 Cephem compounds, processes for their preparation and pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-02-06 EP claimed