SCHEMBL5162220

SCHEMBL5162220

O=C(OCF)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.63
MAPK1 P28482 1/20 0.61
HIF1A Q16665 1/20 0.61
SLC6A2 P23975 1/20 0.61
SLC6A3 Q01959 1/20 0.61
KMT2A Q03164 1/20 0.61
LMNA P02545 3/20 0.59
ALDH1A1 P00352 3/20 0.59
F2 P00734 1/20 0.56
TSHR P16473 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.52
GAA P10253 2/20 0.52
KDM4E B2RXH2 1/20 0.52
RAB9A P51151 3/20 0.50
NPC1 O15118 2/20 0.50
HPGD P15428 2/20 0.50
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
PPARG P37231 1/20 0.49

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
SCHEMBL28140378 0.86 ALDH1A1 (0.54) TDP1MAPK1HIF1ASLC6A2SLC6A3
SCHEMBL20691434 0.84 MAPT (0.53) TDP1MAPK1HIF1ASLC6A2SLC6A3
SCHEMBL27367228 0.84 TDP1 (0.45) TDP1MAPK1HIF1ASLC6A2SLC6A3
SCHEMBL10458171 0.83 TDP1 (0.70) TDP1MAPK1HIF1ASLC6A2SLC6A3
SCHEMBL14477213 0.82 TDP1 (0.63) TDP1MAPK1HIF1ASLC6A2SLC6A3
SCHEMBL16173560 0.82 TDP1 (0.63) TDP1MAPK1HIF1ASLC6A2SLC6A3
SCHEMBL51601 0.81 TDP1 (0.68) TDP1MAPK1HIF1ASLC6A2SLC6A3
SCHEMBL28875175 0.81 TDP1 (0.68) TDP1MAPK1HIF1ASLC6A2SLC6A3
SCHEMBL137486 0.81 TDP1 (0.83) TDP1MAPK1HIF1ASLC6A2SLC6A3
SCHEMBL17459902 0.79 TDP1 (0.78) TDP1MAPK1HIF1ASLC6A2SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115109346-A High-hardness self-lubricating EPDM shaft pin sleeve material and preparation method thereof 安徽亚新科密封技术有限公司 2022-09-27 CN claimed
CN-112851501-A Chemical tracer for fracturing and preparation method and application thereof 中国石油大学(华东) 2021-05-28 CN claimed
CN-106459744-B Double-core main group metal phosphorescent emitters 西门子公司 2019-08-30 CN claimed
CN-107488146-A ICD derivative and its preparation method and application 中国科学院兰州化学物理研究所 2017-12-19 CN claimed
CN-104558284-B Catalytic component for olefinic polymerization and preparation method thereof and the catalyst for olefinic polymerization and application 中国石油化工股份有限公司 2017-09-29 CN claimed
CN-106459744-A Bi-nuclear main group metal phosphorescent emitter 西门子公司 2017-02-22 CN claimed
CN-104558284-A Catalyst component used for olefin polymerization and preparation method thereof as well as catalyst used for olefin polymerization and application CHINA PETROLEUM & CHEMICAL 2015-04-29 CN claimed
CN-103145693-B Preparation method of imatinib CHENGDU BAIYU SCIENCE & TECHNOLOGY PHARMACEUTICAL CO LTD 2015-04-29 CN claimed
CN-103402996-B Indole compounds or analogues thereof useful for the treatment of age-related macular degeneration (AMD) NOVARTIS AG 2015-02-11 CN claimed
CN-102753522-B Substituted pyrrolidine-2-carboxamides HOFFMANN LA ROCHE 2013-11-27 CN claimed
CN-103145693-A Preparation method of imatinib CHENGDU BAIYU TECHNOLOGY PHARMACEUTICAL CO LTD 2013-06-12 CN claimed
CN-101089020-B VIP analog and its radioactive marker and their preparation process SHANGHAI INST APPLIED PHYSICS 2011-04-20 CN claimed
CN-101089020-A VIP analog and its radioactive marker and their prepn process SHANGHAI INST APPLIED PHYSICS (CN) 2007-12-19 CN claimed
CN-119569655-A Pyrazolecarboxamide-containing fluorine methyl thioester benzoate compound and preparation method and application thereof 西北大学 2025-03-07 CN disclosed
CN-115109346-B High-hardness self-lubricating EPDM shaft pin sleeve material and preparation method thereof 安徽亚新科密封技术有限公司 2023-11-14 CN disclosed
WO-2023165591-A1 COMPOUNDS AND THEIR USES AS LPAR5 ANTAGONISTS IMMUTHER PHARMATECH (SHANGHAI) CO., LTD. (CN) 2023-09-07 WO disclosed
US-6187284-B1 REACTING A PEPTIDE COMPRISING A FREE THIOL GROUP WITH AN 18 F-BOUND LABELLING REAGENT WHICH ALSO HAS A GROUP THAT IS REACTIVE WITH THIOLS. IMMUNOMEDICS, INC. 2001-02-13 US disclosed
EP-1009726-A1 FLUORINATION OF PROTEINS AND PEPTIDES FOR F-18 POSITRON EMISSION TOMOGRAPHY Immunomedics, Inc. (US) 2000-06-21 EP disclosed
CN-1227545-A 3-cyanoaryl pyrazoles and use thereof as herbicides BAYER AG (DE) 1999-09-01 CN disclosed
WO-1999011590-A1 FLUORINATION OF PROTEINS AND PEPTIDES FOR F-18 POSITRON EMISSION TOMOGRAPHY IMMUNOMEDICS, INC. (US) 1999-03-11 WO disclosed